| CAS Number | 91567-01-0 |
| Catalog Number | AG00IGRF(AGN-PC-0WRA1M) |
| Chemical Name | N-methyl-5-oxo-1-phenylpyrrolidine-3-carboxamide |
| IUPAC Name | N-methyl-5-oxo-1-phenylpyrrolidine-3-carboxamide |
| InChI | InChI=1S/C12H14N2O2/c1-13-12(16)9-7-11(15)14(8-9)10-5-3-2-4-6-10/h2-6,9H,7-8H2,1H3,(H,13,16) |
| InChI Key | WGDWRORWDHTNBZ-UHFFFAOYSA-N |
| MDL Number | MFCD08090045 |
| Molecular Formula | C12H14N2O2 |
| Molecular Weight | 218.2518 |
| SMILES | CNC(=O)C1CN(C(=O)C1)c1ccccc1 |
| Synonyms | N-methyl-5-oxo-1-phenylpyrrolidine-3-carboxamide,
91567-01-0,
SCHEMBL14817520,
MCULE-5916392949,
V9102,
N~3~-methyl-5-oxo-1-phenyl-3-pyrrolidinecarboxamide,
C12H14N2O2,
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| Complexity | 285 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 218.106g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 218.256g/mol |
| Monoisotopic Mass | 218.106g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 49.4A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.3 |
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Certificate of Analysis
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