Basic information
- CAS
121019-93-0- Standard SMILES
CCOC(=O)C1(c2ccccc2)CCN(C2(c3ccccc3)CCCCC2)CC1- InChIKey
OFTUIURQIJWEPK-UHFFFAOYSA-N- Molecular formula
- C26H33NO2
- Average molar mass
- 391.5 g/mol
- Monoisotopic mass
- 391.2511293
Names & identifiers
- Preferred name
- Ethyl 4-phenyl-1-(1-phenylcyclohexyl)piperidine-4-carboxylate
- IUPAC
- ethyl 4-phenyl-1-(1-phenylcyclohexyl)piperidine-4-carboxylate
Names & synonyms
Ethyl 4-phenyl-1-(1-phenylcyclohexyl)piperidine-4-carboxylate121019-93-0CHEMBL148415DTXSID80153109
Database identifiers
- CAS
121019-93-0- PubChem CID
- 59334
- DTXSID
DTXSID80153109- ChEMBL
CHEMBL148415
Properties
Computed structural properties
- XLogP
- 5.5
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 519
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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