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Compound Summary

ibuprofen

Compound Information

ibuprofen

Compound Name:	ibuprofen
Compound CID:	3672
Synonyms:	ibuprofen 15687-27-1 2-(4-Isobutylphenyl)propanoic acid Motrin Brufen More...
Iupac Name:	2-[4-(2-methylpropyl)phenyl]propanoic acid
InChI:	InChI=1S/C13H18O2/c1-9(2)8-11-4-6-12(7-5-11)10(3)13(14)15/h4-7,9-10H,8H2,1-3H3,(H,14,15)
InChIKey:	HEFNNWSXXWATRW-UHFFFAOYSA-N
Canonical Smiles:	CC(C)CC1=CC=C(C=C1)C(C)C(=O)O
Isomeric Smiles:	CC(C)CC1=CC=C(C=C1)C(C)C(=O)O
Molecular Weight:	206.28
Molecular Formula:	C13H18O2

Compound Structure

2D Structure:

3D Structure:

Computed Properties

ibuprofen

Molecular Weight:	206.28
Molecular Formula:	C13H18O2
Hydrogen Bond Donor Count:	1
Hydrogen Bond Acceptor Count:	2
Rotatable Bond Count:	4
Heavy Atom Count:	15
Complexity:	203

Synonyms

ibuprofen

ibuprofen	ibuprofen
ibuprofen	15687-27-1
2-(4-Isobutylphenyl)propanoic acid	Motrin
Brufen	Advil
Nurofen	Dolgit
Liptan	Nuprin
Anflagen	Buburone
Butylenin	Ibumetin
Ibuprocin	Medipren
Ebufac	Lamidon
2-4-(2-methylpropyl)phenylpropanoic acid	Mynosedin
Apsifen	Epobron
Haltran	Roidenin
Trendar	Adran
Andran	Bluton
Nobfen	Nobgen
PediaProfen	Rufen
Nobfelon	Brufort
Inabrin	Pantrop
Rebugen	Suspren
Tabalon	(RS)-Ibuprofen
Anco	Urem
Ibu-slo	Brufanic
Ibuprohm	Napacetin
Ibufen	Ibren
4-Isobutylhydratropic acid	p-Isobutylhydratropic acid
Proartinal	Dibufen
Optifen	Ostofen
Panafen	Proflex
Quadrax	Uprofen
Burana	Carol
Dolgin	Cobo
(+-)-Ibuprofen	Artril 300
4-Isobutyl-alpha-methylphenylacetic acid	Midol 200
duralbuprofen	Butacortelone
Amibufen	Dolgirid
Ibuprofeno	Lebrufen
Seclodin	Amelior
Femadon	Ibutid
Inoven	alpha-(4-Isobutylphenyl)propionic acid
Brufen Retard	Ibu-Attritin
(+/-)-Ibuprofen	Dolo-Dolgit
IP-82	Caldolor
(+-)-p-Isobutylhydratropic acid	Hydratropic acid, p-isobutyl-
(4-Isobutylphenyl)-alpha-methylacetic acid	Ibu-Tab
p-Isobutyl-2-phenylpropionic acid	RD 13621
(+-)-2-(p-Isobutylphenyl)propionic acid	2-(4-ISOBUTYLPHENYL)PROPIONIC ACID
IB-100	U-18,573
alpha-(p-isobutylphenyl)propionic acid	58560-75-1
Racemic ibuprofen	alpha-p-Isobutylphenylpropionic acid
(+-)-alpha-Methyl-4-(2-methylpropyl)benzeneacetic acid	CHEBI:5855
alpha-Methyl-4-(2-methylpropyl)benzeneacetic acid	Benzeneacetic acid, alpha-methyl-4-(2-methylpropyl)-
Benzeneacetic acid, .alpha.-methyl-4-(2-methylpropyl)-	2-(p-Isobutylphenyl)propionic acid
Novoprofen	Amersol
Dolocyl	Ibuprin
Lidifen	MFCD00010393
Paxofen	Profen
Rafen	CHEMBL521
Ifen	2-(4-Isobutyl-phenyl)-propionic acid
Cap-Profen	Tab-Profen
MLS000069733	(+/-)-2-(4-Isobutylphenyl)Propanoic Acid
Balkaprofen	Betaprofen
Daiprophen	Jenaprofen
Antagil	Antalfene
Antarene	Antiflam
Artofen	Bruflam
Bufigen	Bukrefen
Buracaps	Citalgan
Combiflam	Dansida
Dentigoa	Dignoflex
Dolmaral	Dolofen
Dolofin	Dolofort
Dologel	Dolomax
Doloren	Dolormin
Doltibil	Dorival
Duobrus	Dysdolen
Easifon	Esprenit
Exneural	Femafen
Femapirin	Femidol
Fenspan	Fibraflex
Gelufene	Gynofug
Ibubest	Ibubeta
Ibucasen	Ibudolor
Ibuflamar	Ibugesic
Ibuhexal	Ibulagic
Ibuleve	Ibulgan
Ibumerck	Ibupirac
Junifen	Kratalgin
Librofem	Malafene
Manypren	Mensoton
Neobrufen	Nerofen
Noalgil	Nobafon
Noritis	Novadol
Novogent	Nuprilan
Opturem	Oralfene
Ostarin	Paduden
Perofen	R.D. 13621
Ranofen	Relcofen
Rhinadvil	Sadefen
Salivia	Sednafen
Seklodin	Seskafen
Siyafen	Solpaflex
Sugafen	Suprafen
Syntofene	Tatanal
Unipron	Alaxan
Anafen	Artril
Brofen	Bufeno
Bupron	Dolibu
Dolven	Duafen
Emflam	Eputex
Faspic	Fenbid
Fendol	Grefen
Ibudol	Ibufug
Ibugel	Ibugen
Ibular	Ibulav
Ibumed	Ibusal
Inflam	Isodol
Lopane	Melfen
Moment	Narfen
Ozonol	Provon
Stelar	Tempil
Bloom	Cesra
Cunil	Dalsy
Ergix	Gofen
Ipren	Irfen
Kesan	Rofen
Rufin	Rupan
Tofen	Tonal
Upfen	Zafen
Zofen	Drin
Ibol	Pediatric Advil
Apo-Ibuprofen	Neo-Helvagit
(+/-)-p-Isobutylhydratropic acid	Deep Relief
Ibu-slow	Novo-Profen
Neo-Mindol	Dolofen-F
Donjust B	Nagifen-D
U-18573	Dura-Ibu
Childrens Advil	Motrin IB
Togal N	Childrens Motrin
NSC256857	Ibu-Tab 200
NSC-256857	.alpha.-(p-isobutylphenyl)propionic acid
Childrens Ibuprofen	NCGC00015529-09
Dularbuprofen	Ibuprofenum
.alpha.-(4-Isobutylphenyl)propionic acid	Acide (isobutyl-4 phenyl)-2 propionique
Ibuprofene	Ibuprophen
SMR000058184	Tabalon 400
Junior Strength Advil	4-Isobutyl-.alpha.-methylphenylacetic acid
alpha-Methyl-4-(isobutyl)phenylacetic acid	Brufen 400
Emflam-200	Kontagripp Mono
DOLO PUREN	DSSTox_CID_732
Junior Strength Motrin	Novo Dioxadol
Schmerz-Dolgit	Act-3
Ak+C2278tren	ACHES-N-PAIN
Hemagene Tailleur	Advil Liqui-Gels
Adex 200	Junior Strength Ibuprofen
DSSTox_RID_75759	DSSTox_GSID_20732
Advil, Childrens	Am-Fam 400
Codral Period Pain	Childrens Elixsure
(+-)-Ibuprophen	.alpha.-Methyl-4-(2-methylpropyl)benzeneacetic acid
Midol IB Cramp Relief	Alivium
Genpril	Pedea
Advil migraine	Bayer Select Pain Relief
Ibuprofene INN-French	Ibuprofenum INN-Latin
Perrigo ibuprofen	Ibuprofeno INN-Spanish
MOTRIN MIGRAINE PAIN	Motrin IB Gelcaps
UCB 79171	alpha-(4-Isobutylphenyl)propionate
CAS-15687-27-1	Motrin (TN)
CCRIS 3223	Advil (TN)
CHILDRENS ADVIL-FLAVORED	HSDB 3099
Childrens Elixsure IB	SR-01000000214
EINECS 239-784-6	Advil Migraine Liqui-Gels
U 18573	NSC 256857
BRN 2049713	Ibupril
Ibuprox	Aktren
Ibux	CDT-ibuprofen
Nurofen Meltlets	Ibu
(y)-Ibuprofen	M01AE01
Ibuprofen,(S)	Midol Liquid Gels
(+) ibuprofen	Ibuprofen (Advil)
Acide (isobutyl-4-phenyl)-2 propionique French	(?)-Ibuprofen
(S)-Ibuprofen-d3	p-Isobutylhydratropate
Ibuprofen USAN:USP:INN:BAN:JAN	Combunox (Salt/Mix)
(A+/-)-Ibuprofen	Spectrum_000849
Acide (isobutyl-4-phenyl)-2 propionique	Opera_ID_554
Spectrum2_000129	Spectrum3_000465
Spectrum4_000015	Spectrum5_000862
WLN: QVY&R DIY	CBMicro_005634
ACMC-209df0	ACMC-209ks2
Epitope ID:139973	p-isobutyl-hydratropic acid
(+/-)-2-(4-Isobutylphenyl)-propionic Acid	EC 239-784-6
I 4883	Cambridge id 5152402
SCHEMBL3001	Isobutylpropanoicphenolic acid
Lopac0_000691	BSPBio_002170
Ibuprofen - Adooq Bioscience	Ibuprofen-U-Ring-13C6
KBioGR_000389	KBioSS_001329
MLS001146965	p-Isobutyl-2-phenylpropionate
ARONIS23835	BIDD:GT0050
DivK1c_000887	SPECTRUM1500347
Ibuprofen, >=98% (GC)	SPBio_000178
Ibuprofen (JP17/USP/INN)	alpha-p-Isobutylphenylpropionate
GTPL2713	Motrin IB Gelcaps (Salt/Mix)
2-p-isobutylphenylpropionic acid	DTXSID5020732
HEFNNWSXXWATRW-UHFFFAOYSA-	HMS502M09
KBio1_000887	KBio2_001329
KBio2_003897	KBio2_006465
KBio3_001390	Advil Cold & Sinus (Salt/Mix)
Ibuprofen 1.0 mg/ml in Methanol	NINDS_000887
Sine-Aid IB Caplets (Salt/Mix)	Benzeneacetic acid, alpha-methyl-4-(2-methylpropyl), (+-)-
HMS1920F15	HMS2089P05
HMS2091N03	HMS2230N04
HMS3259G05	HMS3262K03
HMS3372M09	HMS3649M11
HMS3651A15	HMS3884I04
Pharmakon1600-01500347	ACT03248
ALBB-025647	BCP10423
BCP20325	BCP25225
ZAG-1701	( inverted question mark)-Ibuprofen
(.+-.)-p-Isobutylhydratropic acid	Childrens Elixsure IB (Salt/Mix)
Tox21_110170	Tox21_201384
Tox21_302829	Tox21_500691
2-(4-isobutylphenyl)propionic acid	2-(4-isobutylphenyl) propanoic acid
2-(4-isobutylphenyl) propionic acid	2-(4-isobutylphenyl)-propionic acid
BBL010660	BDBM50009859
CCG-38947	NSC757073
s1638	SBB064160
STK177358	(.+/-.)-p-Isobutylhydratropic acid
2-(4-isobutylphenyl)-propionoic acid	2-(4-isobutylphenyl)-propionic acid
AKOS003237488	AKOS016340658
Propanoic acid, 2-(4-isobutylphenyl)	Tox21_110170_1
( inverted exclamation markA)-Ibuprofe	CS-1931
DB01050	KS-5029
LP00691	MCULE-9475454445
NC00458	NSC-757073
SB19113	SDCCGSBI-0050669.P005
ST-1482	( inverted exclamation markA)-Ibuprofen
alpha-(4-isobutylphenyl)-propionic acid	alpha-(p-isobutylphenyl)-propionic acid
IDI1_000887	NCGC00015529-04
NCGC00015529-05	NCGC00015529-06
NCGC00015529-07	NCGC00015529-08
NCGC00015529-10	NCGC00015529-12
NCGC00015529-13	NCGC00015529-14
NCGC00015529-15	NCGC00015529-18
NCGC00015529-32	NCGC00089819-02
NCGC00089819-03	NCGC00089819-04
NCGC00089819-05	NCGC00089819-06
NCGC00089819-07	NCGC00256416-01
NCGC00258935-01	NCGC00261376-01
AC-11312	BI166241
HY-78131	NCI60_002065
ST024750	Ibuprofen, Vetec(TM) reagent grade, 97%
SBI-0050669.P004	(+/-)-2-(p-isobutylphenyl)propionic acid
.alpha.-2-(p-Isobutylphenyl)propionic acid	DB-043333
DB-071312	Ibuprofen, meets USP testing specifications
(.+-.)-2-(p-Isobutylphenyl)propionic acid	4-Isobutylphenyl)-.alpha.-methylacetic acid
AM20060782	BB 0258487
EU-0100691	FT-0601629
FT-0642971	FT-0655194
FT-0670257	FT-0670258
I0415	SW203738-2
(.+/-.)-2-(p-Isobutylphenyl)propionic acid	Ibuprofen, VETRANAL(TM), analytical standard
(r/s)-alpha-methyl-4-isobutylphenylacetic acid	C01588
D00126	J10135
AB00052020-16	AB00052020-17
AB00052020_18	AB00052020_19
(RS)-2-(4-(2-Methylpropyl)phenyl)propanoic acid	687I271
A831926	Q186969
J-009349	SR-01000000214-2
SR-01000000214-4	BRD-A17655518-001-02-0
BRD-A17655518-001-12-9	SR-01000000214-13
F2173-0233	Ibuprofen, British Pharmacopoeia (BP) Reference Standard
Z1695709473	(+/-)-alpha-methyl-4-(2-methylpropyl)benzeneacetic acid
Ibuprofen, European Pharmacopoeia (EP) Reference Standard	Benzeneacetic acid, alpha-methyl-4-(2-methylpropyl), (+/-)-
Ibuprofen, United States Pharmacopeia (USP) Reference Standard	Benzeneacetic acid, .alpha.-methyl-4-(2-methylpropyl), (.+/-.)-
Dexibuprofen;(S)-Ibuprofen; L 669455; L-669,455, MK 233; MK-233	Ibuprofen, Pharmaceutical Secondary Standard; Certified Reference Material
Ibuprofen for peak identification, European Pharmacopoeia (EP) Reference Standard	N4,N4 -Di(naphthalen-1-yl)-N4,N4 -bis(4-vinylphenyl)biphenyl-4,4-diamine
2-(4-Isobutylphenyl)-propionic acid ; alpha-Methyl-4-(2-methylpropyl)benzeneacetic acid ; p-Isobutylhydratropic acid

Experimental Data

ibuprofen

Species	Dose	Unit	Control(Avg days)	Treatment(Avg days)	Avg/Med Lifespan Change(%)	Significant	Strain	PubMed	Avg/Med Lifespan Change tab
Drosophila melanogaster	0.500000000000000	umol/L	48.700000000000000	53.400000000000000	0.100000000000000	S		25521617	Active
Caenorhabditis elegans	0.500000000000000	mM	18.560000000000000	19.990000000000000	0.080000000000000	S	N2	25521617	Active
Caenorhabditis elegans	0.200000000000000	mM	18.560000000000000	20.040000000000000	0.080000000000000	NS	N2	25521617	Inactive
Caenorhabditis elegans	0.010000000000000	mM	18.560000000000000	19.520000000000000	0.050000000000000	S	N2	25521617	Active
Caenorhabditis elegans	0.025000000000000	mM	18.560000000000000	20.460000000000000	0.100000000000000	S	N2	25521617	Active
Caenorhabditis elegans	0.100000000000000	mM	18.560000000000000	20.620000000000000	0.110000000000000	S	N2	25521617	Active
Drosophila melanogaster	0.500000000000000	umol/L	56.400000000000000	61.900000000000000	0.100000000000000	S		25521617	Active
Caenorhabditis elegans	0.400000000000000	mM	18.560000000000000	19.960000000000000	0.080000000000000	S	N2	25521617	Active
Caenorhabditis elegans	0.100000000000000	mM	18.560000000000000	18.650000000000000	0.000000000000000	NS	N2	25521617	Inactive
Drosophila melanogaster	0.300000000000000	umol/L	48.700000000000000	49.200000000000000	0.010000000000000	S		25521617	Active
Drosophila melanogaster	1.000000000000000	umol/L	48.700000000000000	50.500000000000000	0.040000000000000	S		25521617	Active
Drosophila melanogaster	0.300000000000000	umol/L	56.400000000000000	58.700000000000000	0.040000000000000	S		25521617	Active
Drosophila melanogaster	1.000000000000000	umol/L	56.400000000000000	56.500000000000000	0.000000000000000	NS		25521617	Inactive

Experimental Data Visualization

ibuprofen

Statistics Data

ibuprofen

Species	Avg/Med Lifespan Change(%)	Max Lifespan Change(%)	Count Reference	Count Data point
Caenorhabditis elegans	0.110000000000000		1	7
Drosophila melanogaster	0.100000000000000		1	6

Statistics Data Visualization

ibuprofen

Compound Name:

ibuprofen

Compound CID:

3672

Synonyms:

ibuprofen 15687-27-1 2-(4-Isobutylphenyl)propanoic acid Motrin Brufen More...

Iupac Name:

2-[4-(2-methylpropyl)phenyl]propanoic acid

InChI:

InChI=1S/C13H18O2/c1-9(2)8-11-4-6-12(7-5-11)10(3)13(14)15/h4-7,9-10H,8H2,1-3H3,(H,14,15)

InChIKey:

HEFNNWSXXWATRW-UHFFFAOYSA-N

Canonical Smiles:

CC(C)CC1=CC=C(C=C1)C(C)C(=O)O

Isomeric Smiles:

CC(C)CC1=CC=C(C=C1)C(C)C(=O)O

Molecular Weight:

206.28

Molecular Formula:

C13H18O2

Molecular Weight:

206.28

Molecular Formula:

C13H18O2

Hydrogen Bond Donor Count:

1

Hydrogen Bond Acceptor Count:

2

Rotatable Bond Count:

4

Heavy Atom Count:

15

Complexity:

203

ibuprofen

15687-27-1

2-(4-Isobutylphenyl)propanoic acid

Motrin

Brufen

Advil

Nurofen

Dolgit

Liptan

Nuprin

Anflagen

Buburone

Butylenin

Ibumetin

Ibuprocin

Medipren

Ebufac

Lamidon

2-4-(2-methylpropyl)phenylpropanoic acid

Mynosedin

Apsifen

Epobron

Haltran

Roidenin

Trendar

Adran

Andran

Bluton

Nobfen

Nobgen

PediaProfen

Rufen

Nobfelon

Brufort

Inabrin

Pantrop

Rebugen

Suspren

Tabalon

(RS)-Ibuprofen

Anco

Urem

Ibu-slo

Brufanic

Ibuprohm

Napacetin

ibuprofen

15687-27-1

2-(4-Isobutylphenyl)propanoic acid

Motrin

Brufen

More...