| CAS Number | 1263095-23-3 |
| Catalog Number | AG019Z5N(AGN-PC-0WO1NX) |
| Chemical Name | 3-Amino-1-benzyl-1,2-dihydropyridin-2-one |
| IUPAC Name | 3-amino-1-benzylpyridin-2-one |
| InChI | InChI=1S/C12H12N2O/c13-11-7-4-8-14(12(11)15)9-10-5-2-1-3-6-10/h1-8H,9,13H2 |
| InChI Key | HYCFCEZTCJXLDP-UHFFFAOYSA-N |
| MDL Number | MFCD16681307 |
| Molecular Formula | C12H12N2O |
| Molecular Weight | 200.2365 |
| SMILES | NC1C(=O)N(CC2=CC=CC=C2)C=CC=1 |
| Synonyms | 3-amino-1-benzyl-1,2-dihydropyridin-2-one,
1263095-23-3,
SCHEMBL15804049,
ZINC50445468,
AKOS011380057,
MCULE-5718143396,
NE16055,
|
| Complexity | 301 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 200.095g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 200.241g/mol |
| Monoisotopic Mass | 200.095g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 46.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number