Basic information
- CAS
6229-94-3- Standard SMILES
C[C@@H]1C[C@@H](N2CCCCC2)C(=O)N1c1ccccc1.Cl- InChIKey
NCPKFGJFXZBRFD-SWYZXDRTSA-N- Molecular formula
- C16H23ClN2O
- Average molar mass
- 294.82 g/mol
- Monoisotopic mass
- 294.1498911
Names & identifiers
- Preferred name
- 2-Pyrrolidinone, 5-methyl-1-phenyl-3-piperidino-, hydrochloride, (E)-
- IUPAC
- (3R,5R)-5-methyl-1-phenyl-3-piperidin-1-ylpyrrolidin-2-one;hydrochloride
Names & synonyms
6229-94-32-Pyrrolidinone, 5-methyl-1-phenyl-3-piperidino-, hydrochloride, (E)-RefChem:1064801(trans)-5-Methyl-1-phenyl-3-piperidino-2-pyrrolidinone hydrochloride
Database identifiers
- CAS
6229-94-3- PubChem CID
- 111175
Properties
Computed structural properties
- Topological polar surface area
- 23.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 319
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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