Basic information
- Standard SMILES
COc1cccc(OC)c1C1CCC(=O)N1Cc1ccc2ccccc2c1- InChIKey
LLSMZDUNJOKSBC-UHFFFAOYSA-N- Molecular formula
- C23H23NO3
- Average molar mass
- 361.4 g/mol
- Monoisotopic mass
- 361.1677936
Names & identifiers
- Preferred name
- 5-(2,6-Dimethoxyphenyl)-1-(naphthalen-2-ylmethyl)pyrrolidin-2-one
- IUPAC
- 5-(2,6-dimethoxyphenyl)-1-(naphthalen-2-ylmethyl)pyrrolidin-2-one
Names & synonyms
SCHEMBL4532012CHEMBL3972041LLSMZDUNJOKSBC-UHFFFAOYSA-NBDBM202964US9242970, 1115-(2,6-dimethoxyphenyl)-1-(naphthalen-2-ylmethyl)pyrrolidin-2-one
Database identifiers
- PubChem CID
- 69080985
- ChEMBL
CHEMBL3972041
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 38.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 498
Related reactions
1 records
Compound notes
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