Basic information
- Standard SMILES
O=C(C=Cc1ccc(Cl)cc1)NC1CN2CCC1CC2- InChIKey
WUSJALGTATXXGB-UHFFFAOYSA-N- Molecular formula
- C16H19ClN2O
- Average molar mass
- 290.79 g/mol
Names & identifiers
- Preferred name
- N-(1-azabicyclo[2.2.2]octan-3-yl)-3-(4-chlorophenyl)prop-2-enamide
- IUPAC
- N-(1-azabicyclo[2.2.2]octan-3-yl)-3-(4-chlorophenyl)prop-2-enamide
Names & synonyms
SCHEMBL5988211
Database identifiers
- PubChem CID
- 4336544
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 32.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 369
Related reactions
1 records
Compound notes
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