841
Summary
| Name: | ~{N}-[(1-pyridin-2-ylpiperidin-4-yl)methyl]pyrrolidine-1-carboxamide |
| Formula: | C16 H24 N4 O |
| Formal charge: | 0 |
| Formula weight: | 288.388 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.4 | ~{N}-[(1-pyridin-2-ylpiperidin-4-yl)methyl]pyrrolidine-1-carboxamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C16H24N4O/c21-16(20-9-3-4-10-20)18-13-14-6-11-19(12-7-14)15-5-1-2-8-17-15/h1-2,5,8,14H,3-4,6-7,9-13H2,(H,18,21) |
| InChIKey | InChI | 1.03 | FCULEXINIXPVIT-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | O=C(NCC1CCN(CC1)c2ccccn2)N3CCCC3 |
| SMILES | CACTVS | 3.385 | O=C(NCC1CCN(CC1)c2ccccn2)N3CCCC3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.4 | c1ccnc(c1)N2CCC(CC2)CNC(=O)N3CCCC3 |
| SMILES | OpenEye OEToolkits | 2.0.4 | c1ccnc(c1)N2CCC(CC2)CNC(=O)N3CCCC3 |
