W04
Summary
| Name: | N~2~-methyl-N-(4-methylpyridin-2-yl)glycinamide |
| Formula: | C9 H13 N3 O |
| Formal charge: | 0 |
| Formula weight: | 179.219 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | N~2~-methyl-N-(4-methylpyridin-2-yl)glycinamide |
| OpenEye OEToolkits | 2.0.7 | 2-(methylamino)-~{N}-(4-methylpyridin-2-yl)ethanamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | N(C(=O)CNC)c1cc(ccn1)C |
| InChI | InChI | 1.03 | InChI=1S/C9H13N3O/c1-7-3-4-11-8(5-7)12-9(13)6-10-2/h3-5,10H,6H2,1-2H3,(H,11,12,13) |
| InChIKey | InChI | 1.03 | MKMXMYQLOQBORD-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CNCC(=O)Nc1cc(C)ccn1 |
| SMILES | CACTVS | 3.385 | CNCC(=O)Nc1cc(C)ccn1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cc1ccnc(c1)NC(=O)CNC |
| SMILES | OpenEye OEToolkits | 2.0.7 | Cc1ccnc(c1)NC(=O)CNC |
