Benzamide, N-(5,5-dimethyl-3-oxo-1-cyclohexen-1-yl)-
Basic information
- CAS
23674-57-9- Standard SMILES
CC1(C)CC(=O)C=C(NC(=O)c2ccccc2)C1- InChIKey
XAXJAVCKMWVKNB-UHFFFAOYSA-N- Molecular formula
- C15H17NO2
- Average molar mass
- 243.3 g/mol
- Monoisotopic mass
- 243.12592879
Names & identifiers
- Preferred name
- Benzamide, N-(5,5-dimethyl-3-oxo-1-cyclohexen-1-yl)-
- IUPAC
- N-(5,5-dimethyl-3-oxocyclohexen-1-yl)benzamide
Names & synonyms
23674-57-9N-(5,5-dimethyl-3-oxocyclohex-1-en-1-yl)benzamideNSC620518Benzamide, N-(5,5-dimethyl-3-oxo-1-cyclohexen-1-yl)-CHEMBL1977390SCHEMBL25439947DTXSID20326890NSC-620518NCI60_006063
Database identifiers
- CAS
23674-57-9- PubChem CID
- 359535
- DTXSID
DTXSID20326890- ChEMBL
CHEMBL1977390
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 46.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 376
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Compound notes
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