Basic information
- Standard SMILES
CO[C@@H]1CN(Cc2ccccc2)C[C@H]1O- InChIKey
ZZBLMCUYQQVQEW-VXGBXAGGSA-N- Molecular formula
- C12H17NO2
- Average molar mass
- 207.27 g/mol
Names & identifiers
- Preferred name
- trans-1-Benzyl-3-hydroxy-4-methoxypyrrolidine
- IUPAC
- (3R,4R)-1-benzyl-4-methoxypyrrolidin-3-ol
Names & synonyms
SCHEMBL6212846ZZBLMCUYQQVQEW-VXGBXAGGSA-Ntrans-1-Benzyl-3-hydroxy-4-methoxypyrrolidine
Database identifiers
- PubChem CID
- 15069965
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 32.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 192
Related reactions
8 records
Compound notes
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