Basic information
- Standard SMILES
CCOC(=O)CN(C)C1(c2ccccc2)CCC(=O)CC1- InChIKey
NUBXVJDXQKYFTN-UHFFFAOYSA-N- Molecular formula
- C17H23NO3
- Average molar mass
- 289.4 g/mol
Names & identifiers
- Preferred name
- 4-[[(Ethoxycarbonyl)methyl]methylamino]-4-phenylcyclohexanone
- IUPAC
- ethyl 2-[methyl-(4-oxo-1-phenylcyclohexyl)amino]acetate
Names & synonyms
SCHEMBL11095408NUBXVJDXQKYFTN-UHFFFAOYSA-N4-[[(ethoxycarbonyl)methyl]methylamino]-4-phenylcyclohexanone
Database identifiers
- PubChem CID
- 21390951
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 46.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 364
Related reactions
3 records
Compound notes
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