Basic information
- Standard SMILES
NC1(C(=O)N[C@@H](CCO)c2ccc(Cl)cc2)CCNCC1- InChIKey
ZRDYBUCARNESOB-ZDUSSCGKSA-N- Molecular formula
- C15H22ClN3O2
- Average molar mass
- 311.81 g/mol
Names & identifiers
- Preferred name
- (S)-4-amino-N-(1-(4-chlorophenyl)-3-hydroxypropyl)piperidine-4-carboxamide
- IUPAC
- 4-amino-N-[(1S)-1-(4-chlorophenyl)-3-hydroxypropyl]piperidine-4-carboxamide
Names & synonyms
SCHEMBL393775ZRDYBUCARNESOB-ZDUSSCGKSA-N(S)-4-amino-N-(1-(4-chlorophenyl)-3-hydroxypropyl)piperidine-4-carboxamide
Database identifiers
- PubChem CID
- 57750388
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 87.4 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 340
Related reactions
5 records
Compound notes
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