Basic information
- CAS
64097-67-2- Standard SMILES
CN1CCC(C)(c2ccccc2)C1=O- InChIKey
KOVIAQSCOUNWFG-UHFFFAOYSA-N- Molecular formula
- C12H15NO
- Average molar mass
- 189.25 g/mol
- Monoisotopic mass
- 189.1153641
Names & identifiers
- Preferred name
- 1,3-Dimethyl-3-phenylpyrrolidin-2-one
- IUPAC
- 1,3-dimethyl-3-phenylpyrrolidin-2-one
Names & synonyms
1,3-Dimethyl-3-phenylpyrrolidin-2-one64097-67-2SCHEMBL28760658DTXSID20494826
Database identifiers
- CAS
64097-67-2- PubChem CID
- 12371161
- DTXSID
DTXSID20494826
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 20.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 232
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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