Basic information
- Standard SMILES
COC(=O)[C@@H]1CC(Cc2ccccc2)CN1- InChIKey
YTGOEWZIIDHBGD-KIYNQFGBSA-N- Molecular formula
- C13H17NO2
- Average molar mass
- 219.28 g/mol
- Monoisotopic mass
- 219.12592879
Names & identifiers
- Preferred name
- 4-benzyl-L-proline methyl ester
- IUPAC
- methyl (2S)-4-benzylpyrrolidine-2-carboxylate
Names & synonyms
SCHEMBL70179224-benzyl-L-proline methyl esterYTGOEWZIIDHBGD-KIYNQFGBSA-N
Database identifiers
- PubChem CID
- 54526192
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 236
Related reactions
3 records
Compound notes
Loading…