Basic information
- Standard SMILES
CCOC(=O)N1CCC(Oc2ccc(C)cc2)C(c2ccccc2)C1- InChIKey
DFDJZHMTEWAQRV-UHFFFAOYSA-N- Molecular formula
- C21H25NO3
- Average molar mass
- 339.4 g/mol
Names & identifiers
- Preferred name
- Ethyl 4-(4-methylphenoxy)-3-phenylpiperidine-1-carboxylate
- IUPAC
- ethyl 4-(4-methylphenoxy)-3-phenylpiperidine-1-carboxylate
Names & synonyms
SCHEMBL11175904
Database identifiers
- PubChem CID
- 20503530
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 38.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 413
Related reactions
1 records
Compound notes
Loading…