Basic information
- Standard SMILES
N#C[C@@H]1CCC(NOCc2ccccc2)CN1- InChIKey
VTHYPXYGIBXRQP-UEWDXFNNSA-N- Molecular formula
- C13H17N3O
- Average molar mass
- 231.29 g/mol
Names & identifiers
- Preferred name
- (2S)-5-[(benzyloxy)amino]-2-cyanopiperidine
- IUPAC
- (2S)-5-(phenylmethoxyamino)piperidine-2-carbonitrile
Names & synonyms
SCHEMBL16107370VTHYPXYGIBXRQP-UEWDXFNNSA-N(2S)-5-[(benzyloxy)amino]-2-cyanopiperidine
Database identifiers
- PubChem CID
- 117599345
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 57.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 267
Related reactions
15 records
Compound notes
Loading…