5-oxo-N-phenylpyrrolidine-2-carboxamide
Basic information
- CAS
5626-54-0- Standard SMILES
O=C1CCC(C(=O)Nc2ccccc2)N1- InChIKey
DLHWPLFJAJCANU-UHFFFAOYSA-N- Molecular formula
- C11H12N2O2
- Average molar mass
- 204.22 g/mol
- Monoisotopic mass
- 204.08987763
Names & identifiers
- Preferred name
- 5-oxo-N-phenylpyrrolidine-2-carboxamide
- IUPAC
- 5-oxo-N-phenylpyrrolidine-2-carboxamide
- English name
- 2-Pyrrolidinecarboxamide, 5-oxo-N-phenyl-
- Molecular formula
- C11H12N2O2
- Molecular weight
- 204.23
Names & synonyms
5-oxo-N-phenylpyrrolidine-2-carboxamide5626-54-05-oxo-N-phenylprolinamide5-Oxo-pyrrolidine-2-carboxylic acid phenylamideNSC42356CBMicro_000424Cambridge id 5878458Oprea1_280279MLS000529074SCHEMBL2222173CHEMBL1726841DLHWPLFJAJCANU-UHFFFAOYSA-N
Show more names
2-Pyrrolidinecarboxamide, 5-oxo-N-phenyl-
DTXSID701031778HMS1693K04HMS2327N12SMSF0009050(5-oxopyrrolidin-2-yl)-N-benzamideNSC-42356STK889360AKOS001632547
Database identifiers
- CAS
5626-54-0- PubChem CID
- 238147
- DTXSID
DTXSID701031778- ChEMBL
CHEMBL1726841
Properties
Computed structural properties
- XLogP
- 0.5
- Topological polar surface area
- 58.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 259
Physicochemical properties
- Melting point
- 204 °C · 204 °C
- Boiling point
- 535.1 · 535.1±43.0 °C(Predicted)
- Density
- 1.277 · 1.277±0.06 g/cm3(Predicted)
- pka
- 13.51 · 13.51±0.70(Predicted)
Chemistry & industry
Upstream & downstream products
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