A1IPM
Summary
| Name: | 1,4-dimethyl-6-(methylamino)pyridine-3-carboxamide |
| Formula: | C9 H14 N3 O |
| Formal charge: | 1 |
| Formula weight: | 180.227 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 1,4-dimethyl-6-(methylamino)pyridin-1-ium-3-carboxamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C9H13N3O/c1-6-4-8(11-2)12(3)5-7(6)9(10)13/h4-5H,1-3H3,(H2,10,13)/p+1 |
| InChIKey | InChI | 1.06 | MGBQINHGHQAWPO-UHFFFAOYSA-O |
| SMILES_CANONICAL | CACTVS | 3.385 | CNc1cc(C)c(c[n+]1C)C(N)=O |
| SMILES | CACTVS | 3.385 | CNc1cc(C)c(c[n+]1C)C(N)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cc1cc([n+](cc1C(=O)N)C)NC |
| SMILES | OpenEye OEToolkits | 2.0.7 | Cc1cc([n+](cc1C(=O)N)C)NC |
