NJ6
Summary
| Name: | 2-[(4-azanylcyclohexyl)amino]-7-cyclopentyl-~{N},~{N}-dimethyl-pyrrolo[2,3-d]pyrimidine-6-carboxamide |
| Formula: | C20 H30 N6 O |
| Formal charge: | 0 |
| Formula weight: | 370.492 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 2-[(4-azanylcyclohexyl)amino]-7-cyclopentyl-~{N},~{N}-dimethyl-pyrrolo[2,3-d]pyrimidine-6-carboxamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C20H30N6O/c1-25(2)19(27)17-11-13-12-22-20(23-15-9-7-14(21)8-10-15)24-18(13)26(17)16-5-3-4-6-16/h11-12,14-16H,3-10,21H2,1-2H3,(H,22,23,24)/t14-,15- |
| InChIKey | InChI | 1.06 | HZJPJDOVXYTUTI-SHTZXODSSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CN(C)C(=O)c1cc2cnc(N[C@H]3CC[C@H](N)CC3)nc2n1C4CCCC4 |
| SMILES | CACTVS | 3.385 | CN(C)C(=O)c1cc2cnc(N[CH]3CC[CH](N)CC3)nc2n1C4CCCC4 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CN(C)C(=O)c1cc2cnc(nc2n1C3CCCC3)NC4CCC(CC4)N |
| SMILES | OpenEye OEToolkits | 2.0.7 | CN(C)C(=O)c1cc2cnc(nc2n1C3CCCC3)NC4CCC(CC4)N |
