4-(Acetylamino)-6,7-dihydro-5h-cyclopenta[b]pyridin-2-yl acetate
Basic information
- CAS
5338-31-8- Standard SMILES
CC(=O)Nc1cc(OC(C)=O)nc2c1CCC2- InChIKey
YVCXKTDSXXESRU-UHFFFAOYSA-N- Molecular formula
- C12H14N2O3
- Average molar mass
- 234.25 g/mol
- Monoisotopic mass
- 234.10044231
Names & identifiers
- Preferred name
- 4-(Acetylamino)-6,7-dihydro-5h-cyclopenta[b]pyridin-2-yl acetate
- IUPAC
- (4-acetamido-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl) acetate
Names & synonyms
5338-31-84-(acetylamino)-6,7-dihydro-5h-cyclopenta[b]pyridin-2-yl acetateNSC3144DTXSID80277612NSC-31444-Acetamido-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl acetate
Database identifiers
- CAS
5338-31-8- PubChem CID
- 220412
- DTXSID
DTXSID80277612
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 68.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 319
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Compound notes
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