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Basic information
- Standard SMILES
CCN1C(=O)C(C)(C)C[C@H]1C(=O)NCc1ccc(F)c(F)c1Cl- InChIKey
BGKBNXKFYODKEE-NSHDSACASA-N- Molecular formula
- C16H19ClF2N2O2
- Average molar mass
- 344.78 g/mol
- Monoisotopic mass
- 344.1103119
Names & identifiers
- Preferred name
- N-[(2-chloro-3,4-difluorophenyl)methyl]-1-ethyl-4,4-dimethyl-5-oxoprolinamide
- IUPAC
- (2S)-N-[(2-chloro-3,4-difluorophenyl)methyl]-1-ethyl-4,4-dimethyl-5-oxopyrrolidine-2-carboxamide
Names & synonyms
SCHEMBL2582198CHEMBL2218698BGKBNXKFYODKEE-NSHDSACASA-NN-[(2-chloro-3,4-difluorophenyl)methyl]-1-ethyl-4,4-dimethyl-5-oxoprolinamide
Database identifiers
- PubChem CID
- 67461981
- ChEMBL
CHEMBL2218698
Properties
Computed structural propertiesFilling in
- XLogP
- 2.8
- Topological polar surface area
- 49.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 475
Related reactions
2 records
Compound notes
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