Basic information
- Standard SMILES
O=C(Nc1ccc(-c2ccccc2CO)cc1)C1CN2CCC1CC2- InChIKey
NGRUDZJVXPTATN-UHFFFAOYSA-N- Molecular formula
- C21H24N2O2
- Average molar mass
- 336.4 g/mol
Names & identifiers
- Preferred name
- N-[4-[2-(hydroxymethyl)phenyl]phenyl]-1-azabicyclo[2.2.2]octane-3-carboxamide
- IUPAC
- N-[4-[2-(hydroxymethyl)phenyl]phenyl]-1-azabicyclo[2.2.2]octane-3-carboxamide
Database identifiers
- PubChem CID
- 21883441
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 453
Related reactions
1 records
Compound notes
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