A1BM3
Summary
| Name: | N,N-diethyl-2-methylpyrimidine-4-carboxamide |
| Formula: | C10 H15 N3 O |
| Formal charge: | 0 |
| Formula weight: | 193.246 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 14.52 | N,N-diethyl-2-methylpyrimidine-4-carboxamide |
| OpenEye OEToolkits | 3.1.0.0 | ~{N},~{N}-diethyl-2-methyl-pyrimidine-4-carboxamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | O=C(c1ccnc(C)n1)N(CC)CC |
| InChI | InChI | 1.06 | InChI=1S/C10H15N3O/c1-4-13(5-2)10(14)9-6-7-11-8(3)12-9/h6-7H,4-5H2,1-3H3 |
| InChIKey | InChI | 1.06 | MBLSTDCRYDGJKF-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCN(CC)C(=O)c1ccnc(C)n1 |
| SMILES | CACTVS | 3.385 | CCN(CC)C(=O)c1ccnc(C)n1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | CCN(CC)C(=O)c1ccnc(n1)C |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | CCN(CC)C(=O)c1ccnc(n1)C |
