Basic information
- Standard SMILES
CC(C)(C(=O)O)c1ccc(C(=O)CCCCl)cc1.NC(=O)N1CCCC1- InChIKey
OWYHBAVKYWLLKR-UHFFFAOYSA-N- Molecular formula
- C19H27ClN2O4
- Average molar mass
- 382.9 g/mol
- Monoisotopic mass
- 382.165935
Names & identifiers
- Preferred name
- 2-[4-(4-Chloro-butyryl)-phenyl]-2-methyl-propionic acid pyrrolidineamide
- IUPAC
- 2-[4-(4-chlorobutanoyl)phenyl]-2-methylpropanoic acid;pyrrolidine-1-carboxamide
Names & synonyms
SCHEMBL6784890OWYHBAVKYWLLKR-UHFFFAOYSA-N2-[4-(4-Chloro-butyryl)-phenyl]-2-methyl-propionic acid pyrrolidineamide
Database identifiers
- PubChem CID
- 69894650
Properties
Computed structural properties
- Topological polar surface area
- 101 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 401
Related reactions
5 records
Compound notes
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