Basic information
- Standard SMILES
CC(C)(C)C(=O)N1C(=O)[C@H](O)C[C@H]1Cc1ccc(-c2ccccc2)cc1- InChIKey
REWATPLBUYHLSU-RTBURBONSA-N- Molecular formula
- C22H25NO3
- Average molar mass
- 351.4 g/mol
- Monoisotopic mass
- 351.18344366
Names & identifiers
- Preferred name
- (3R,5R)-5-Biphenyl-4-ylmethyl-1-(2,2-dimethylpropionyl)-3-hydroxypyrrolidin-2-one
- IUPAC
- (3R,5R)-1-(2,2-dimethylpropanoyl)-3-hydroxy-5-[(4-phenylphenyl)methyl]pyrrolidin-2-one
Names & synonyms
SCHEMBL9929765REWATPLBUYHLSU-RTBURBONSA-N(3R,5R)-5-Biphenyl-4-ylmethyl-1-(2,2-dimethylpropionyl)-3-hydroxypyrrolidin-2-one
Database identifiers
- PubChem CID
- 67969475
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 57.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 510
Related reactions
6 records
Compound notes
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