JNO
Summary
| Name: | 2-{4-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]piperidin-1-yl}-N-methylacetamide |
| Formula: | C19 H23 N7 O |
| Formal charge: | 0 |
| Formula weight: | 365.432 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 2-{4-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]piperidin-1-yl}-N-methylacetamide |
| OpenEye OEToolkits | 1.5.0 | 2-[4-[(4-imidazo[3,2-a]pyridin-3-ylpyrimidin-2-yl)amino]piperidin-1-yl]-N-methyl-ethanamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(NC)CN4CCC(Nc3nc(c2cnc1ccccn12)ccn3)CC4 |
| SMILES_CANONICAL | CACTVS | 3.341 | CNC(=O)CN1CCC(CC1)Nc2nccc(n2)c3cnc4ccccn34 |
| SMILES | CACTVS | 3.341 | CNC(=O)CN1CCC(CC1)Nc2nccc(n2)c3cnc4ccccn34 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CNC(=O)CN1CCC(CC1)Nc2nccc(n2)c3cnc4n3cccc4 |
| SMILES | OpenEye OEToolkits | 1.5.0 | CNC(=O)CN1CCC(CC1)Nc2nccc(n2)c3cnc4n3cccc4 |
| InChI | InChI | 1.03 | InChI=1S/C19H23N7O/c1-20-18(27)13-25-10-6-14(7-11-25)23-19-21-8-5-15(24-19)16-12-22-17-4-2-3-9-26(16)17/h2-5,8-9,12,14H,6-7,10-11,13H2,1H3,(H,20,27)(H,21,23,24) |
| InChIKey | InChI | 1.03 | AJLILYAPRHIFAS-UHFFFAOYSA-N |
