Basic information
- Standard SMILES
O=C1CCC(C(c2ccccc2)c2ccccc2)CN1CCCc1cccc(O)c1- InChIKey
WJCQOQZOIYRKJS-UHFFFAOYSA-N- Molecular formula
- C27H29NO2
- Average molar mass
- 399.5 g/mol
- Monoisotopic mass
- 399.21982917
Names & identifiers
- Preferred name
- 5-(Diphenylmethyl)-1-[3-(3-hydroxyphenyl)propyl]piperidin-2-one
- IUPAC
- 5-benzhydryl-1-[3-(3-hydroxyphenyl)propyl]piperidin-2-one
Names & synonyms
SCHEMBL3174271WJCQOQZOIYRKJS-UHFFFAOYSA-N5-(diphenylmethyl)-1-[3-(3-hydroxyphenyl)propyl]piperidin-2-one
Database identifiers
- PubChem CID
- 68538015
Properties
Computed structural properties
- XLogP
- 5.4
- Topological polar surface area
- 40.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 7
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 505
Related reactions
1 records
Compound notes
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