Anodyne| CPX | |
|---|---|
 | |
| Molecular structure via molpic based on CDK |
| Physical properties [] | |
|---|---|
| Molecular mass | 248.28 g/mol [1] |
| Solubility | >37.2 [ug/mL] (The mean of the results at pH 7.4) [1] |
| Predicted LogP | 1.6 [1] |
| Structural Identifiers [] | |
|---|---|
| Molecular formula | C12H16N4O2 [1] |
| IUPAC name | 8-cyclopentyl-1,3-dimethyl-7H-purine-2,6-dione [1] |
| SMILES | CN1C2=C(C(=O)N(C1=O)C)NC(=N2)C3CCCC3 [1] |
| 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) [1] |
| InChIKey | SCVHFRLUNIOSGI-UHFFFAOYSA-N [1] |
8-Cyclopentyltheophylline
8-Cyclopentyltheophylline (also known as 8-Cyclopentyl-1,3-dimethylxanthine, 8-Cyclopentyl-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione, 1H-Purine-2,6-dione, 8-cyclopentyl-3,7-dihydro-1,3-dimethyl-, 1,3-dimethyl-8-cyclopentylxanthine, 8-Cyclopentyl theophylline, Xanthine, 8-cyclopentyl-1,3-dimethyl-, Theophylline, 8-cyclopentyl-, Spectrum_000351, Lopac-C-102 or 1H-Purine-2,6-dione, 8-cyclopentyl-3,9-dihydro-1,3-dimethyl-) is a
Chemistry
Stereochemistry []
8-Cyclopentyltheophylline is a achiral mixture
See also []
External links []
- 8-Cyclopentyltheophylline (Wikipedia)
- 8-Cyclopentyltheophylline (Wikidata)
- 8-Cyclopentyltheophylline (PubChem)
- 8-Cyclopentyltheophylline (ChEMBL)
- 8-Cyclopentyltheophylline (ChEBI)
- 8-Cyclopentyltheophylline (Probes & Drugs)
- 8-Cyclopentyltheophylline (Common Chemistry)
- 8-Cyclopentyltheophylline (HMDB)
- 8-Cyclopentyltheophylline (UNII)
- 8-Cyclopentyltheophylline (EPA DSSTox)
References []
National Center for Biotechnology Information. PubChem Compound Summary for CID 1917, 8-Cyclopentyltheophylline. Accessed June 27, 2025. https://pubchem.ncbi.nlm.nih.gov/compound/1917
U.S. Food and Drug Administration; National Center for Advancing Translational Sciences. 8-Cyclopentyltheophylline. UNII: U7PWT4CPL5. Global Substance Registration System. Accessed June 27, 2025. https://gsrs.ncats.nih.gov/ginas/app/beta/substances/U7PWT4CPL5