| CAS Number | 1314985-80-2 |
| Catalog Number | AG000WC2(AGN-PC-0BGIIR) |
| Chemical Name | 3-(6-Aminopyridin-3-yl)-N-methylbenzamide |
| IUPAC Name | 3-(6-aminopyridin-3-yl)-N-methylbenzamide |
| InChI | InChI=1S/C13H13N3O/c1-15-13(17)10-4-2-3-9(7-10)11-5-6-12(14)16-8-11/h2-8H,1H3,(H2,14,16)(H,15,17) |
| InChI Key | TXSBKBNHWHZVLY-UHFFFAOYSA-N |
| MDL Number | MFCD19684168 |
| Molecular Formula | C13H13N3O |
| Molecular Weight | 227.2618 |
| SMILES | CNC(=O)c1cccc(c1)c1ccc(nc1)N |
| Synonyms | 3-(6-Aminopyridin-3-yl)-N-methylbenzamide,
1314985-80-2,
ACMC-209bm6,
CTK8B0103,
DTXSID90718566,
ANW-19324,
MFCD19684168,
ZINC85476790,
CJ-22356,
TC-108069,
Z9590,
Benzamide, 3-(6-amino-3-pyridinyl)-N-methyl-,
C13H13N3O,
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| Complexity | 269 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 227.106g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 227.267g/mol |
| Monoisotopic Mass | 227.106g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 68A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number