A1A0E
Summary
| Name: | (2M)-4-methyl-5'-[(methylamino)methyl][2,3'-bipyridin]-6-amine |
| Formula: | C13 H16 N4 |
| Formal charge: | 0 |
| Formula weight: | 228.293 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | (2M)-4-methyl-5'-[(methylamino)methyl][2,3'-bipyridin]-6-amine |
| OpenEye OEToolkits | 2.0.7 | 4-methyl-6-[5-(methylaminomethyl)pyridin-3-yl]pyridin-2-amine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | Cc1cc(nc(N)c1)c1cc(CNC)cnc1 |
| InChI | InChI | 1.06 | InChI=1S/C13H16N4/c1-9-3-12(17-13(14)4-9)11-5-10(6-15-2)7-16-8-11/h3-5,7-8,15H,6H2,1-2H3,(H2,14,17) |
| InChIKey | InChI | 1.06 | HVNNTPIADDMWDC-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CNCc1cncc(c1)c2cc(C)cc(N)n2 |
| SMILES | CACTVS | 3.385 | CNCc1cncc(c1)c2cc(C)cc(N)n2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cc1cc(nc(c1)N)c2cc(cnc2)CNC |
| SMILES | OpenEye OEToolkits | 2.0.7 | Cc1cc(nc(c1)N)c2cc(cnc2)CNC |
