1-Acetyl-piperidine-4-carboxylic acid {4-[(S)-3-((S)-2-methyl-pyrrolidin-1-yl)-cyclopentyl]-phenyl}-amide
Basic information
- Standard SMILES
CC(=O)N1CCC(C(=O)Nc2ccc([C@H]3CCC(N4CCC[C@@H]4C)C3)cc2)CC1- InChIKey
RWVQOEJTUMUHQH-AFCKPWEZSA-N- Molecular formula
- C24H35N3O2
- Average molar mass
- 397.6 g/mol
Names & identifiers
- Preferred name
- 1-Acetyl-piperidine-4-carboxylic acid {4-[(S)-3-((S)-2-methyl-pyrrolidin-1-yl)-cyclopentyl]-phenyl}-amide
- IUPAC
- 1-acetyl-N-[4-[(1S)-3-[(2S)-2-methylpyrrolidin-1-yl]cyclopentyl]phenyl]piperidine-4-carboxamide
Names & synonyms
CHEMBL3968127SCHEMBL12185106RWVQOEJTUMUHQH-AFCKPWEZSA-NBDBM247463US9453023, 221-Acetyl-piperidine-4-carboxylic acid {4-[(S)-3-((S)-2-methyl-pyrrolidin-1-yl)-cyclopentyl]-phenyl}-amide
Database identifiers
- PubChem CID
- 68212291
- ChEMBL
CHEMBL3968127
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 52.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 579
Related reactions
1 records
Compound notes
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