Basic information
- Standard SMILES
C=C(C)CN1C(=O)CCC1C(=O)NCc1ccc(F)cc1Cl- InChIKey
KMOLTUAVIKNTBH-UHFFFAOYSA-N- Molecular formula
- C16H18ClFN2O2
- Average molar mass
- 324.78 g/mol
Names & identifiers
- Preferred name
- N-[(2-chloro-4-fluorophenyl)methyl]-1-(2-methylprop-2-enyl)-5-oxopyrrolidine-2-carboxamide
- IUPAC
- N-[(2-chloro-4-fluorophenyl)methyl]-1-(2-methylprop-2-enyl)-5-oxopyrrolidine-2-carboxamide
Names & synonyms
SCHEMBL2578220
Database identifiers
- PubChem CID
- 42641018
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 49.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 457
Related reactions
1 records
Compound notes
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