Compound Summary
Compound Information
8-Cyclopentyl-1,3-dimethylxanthine
Compound Name: | 8-Cyclopentyl-1,3-dimethylxanthine |
Compound CID: | 1917 |
Synonyms: | 8-Cyclopentyl-1,3-dimethylxanthine 8-cyclopentyltheophylline 35873-49-5 8-Cyclopentyl-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione 8-cyclopentyl-1,3-dimethyl-7H-purine-2,6-dione More... |
Iupac Name: | 8-cyclopentyl-1,3-dimethyl-7H-purine-2,6-dione |
InChI: | InChI=1S/C12H16N4O2/c1-15-10-8(11(17)16(2)12(15)18)13-9(14-10)7-5-3-4-6-7/h7H,3-6H2,1-2H3,(H,13,14) |
InChIKey: | SCVHFRLUNIOSGI-UHFFFAOYSA-N |
Canonical Smiles: | CN1C2=C(C(=O)N(C1=O)C)NC(=N2)C3CCCC3 |
Isomeric Smiles: | CN1C2=C(C(=O)N(C1=O)C)NC(=N2)C3CCCC3 |
Molecular Weight: | 248.28 |
Molecular Formula: | C12H16N4O2 |
Compound Structure
2D Structure:
3D Structure:
Computed Properties
8-Cyclopentyl-1,3-dimethylxanthine
Molecular Weight: | 248.28 |
Molecular Formula: | C12H16N4O2 |
Hydrogen Bond Donor Count: | 1 |
Hydrogen Bond Acceptor Count: | 3 |
Rotatable Bond Count: | 1 |
Heavy Atom Count: | 18 |
Complexity: | 380 |
Synonyms
8-Cyclopentyl-1,3-dimethylxanthine
| 8-Cyclopentyl-1,3-dimethylxanthine | 8-Cyclopentyl-1,3-dimethylxanthine |
|---|---|
8-Cyclopentyl-1,3-dimethylxanthine |
8-cyclopentyltheophylline |
35873-49-5 |
8-Cyclopentyl-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione |
8-cyclopentyl-1,3-dimethyl-7H-purine-2,6-dione |
UNII-U7PWT4CPL5 |
U7PWT4CPL5 |
CHEMBL106265 |
8-Cyclopentyl theophylline |
NSC 101806 |
BRN 1133199 |
Xanthine, 8-cyclopentyl-1,3-dimethyl- |
Theophylline, 8-cyclopentyl- |
Spectrum_000351 |
Lopac-C-102 |
Spectrum2_001734 |
Spectrum3_000658 |
Spectrum4_000760 |
Spectrum5_001769 |
NCIOpen2_006919 |
Lopac0_000391 |
BSPBio_002295 |
GTPL385 |
KBioGR_001120 |
KBioSS_000831 |
MLS000859932 |
DivK1c_000824 |
SCHEMBL431907 |
SPECTRUM2300193 |
SPBio_001808 |
CPT; 8-Cyclopentyltheophylline |
8-cyclopentyltheophylline (cpt) |
SCHEMBL18029489 |
BDBM81925 |
HMS502J06 |
KBio1_000824 |
KBio2_000831 |
KBio2_003399 |
KBio2_005967 |
KBio3_001515 |
DTXSID70189432 |
CHEBI:109538 |
NINDS_000824 |
HMS2231K17 |
HMS3261O03 |
HMS3374O03 |
1H-Purine-2,6-dione, 8-cyclopentyl-3,9-dihydro-1,3-dimethyl- |
CAS_1917 |
NSC_1917 |
Tox21_500391 |
CCG-39502 |
MFCD00055116 |
NSC101806 |
PDSP1_000994 |
PDSP2_000978 |
ZINC15880093 |
AKOS030211020 |
CCG-221695 |
CS-W012671 |
LP00391 |
NSC-101806 |
SDCCGSBI-0050378.P003 |
IDI1_000824 |
Mol Pharmacol 29: 331 (1986) |
NCGC00015178-01 |
NCGC00015178-02 |
NCGC00015178-03 |
NCGC00015178-04 |
NCGC00015178-05 |
NCGC00015178-06 |
NCGC00015178-07 |
NCGC00015178-10 |
NCGC00093819-01 |
NCGC00093819-02 |
NCGC00093819-03 |
NCGC00093819-04 |
NCGC00261076-01 |
SMR000326793 |
DB-048886 |
C-102 |
EU-0100391 |
FT-0639285 |
E72267 |
L000085 |
SR-01000075232 |
Q4644273 |
SR-01000075232-1 |
BRD-K38347298-001-02-3 |
BRD-K38347298-001-06-4 |
1H-Purine-2, 8-cyclopentyl-3,7-dihydro-1,3-dimethyl- |
8-Cyclopentyl-1,3-dimethyl-3,7-dihydro-purine-2,6-dione |
8-Cyclopentyl-1,3-dimethylxanthine, >=98% (HPLC), powder |
1H-Purine-2,6-dione, 8-cyclopentyl-3,7-dihydro-1,3-dimethyl- (9CI) |
Experimental Data
8-Cyclopentyl-1,3-dimethylxanthine
| Species | Dosage | Unit | CG Lifespan(AVG/MED days) | TG Lifespan(AVG/MED days) | Lifespan Change(AVG/MED%) | CG Lifespan(MAX days) | TG Lifespan(MAX days) | Lifespan Change(MAX%) | Significant | Strain | Gender | PubMed | Active Label |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Caenorhabditis elegans | 33 | umol/L | 0 | NS | N2 | 24134630 | Inactive |
Experimental Data Visualization
8-Cyclopentyl-1,3-dimethylxanthine
Statistics Data
8-Cyclopentyl-1,3-dimethylxanthine
| Species | Lifespan Change(AVG/MED%) | Lifespan Change(MAX%) | Count Reference | Count Data point |
|---|---|---|---|---|
| Caenorhabditis elegans | 0 | 1 | 1 |
Statistics Data Visualization
8-Cyclopentyl-1,3-dimethylxanthine
