A1AJ9
Summary
| Name: | 4-methoxy-2-(piperazin-1-yl)pyrimidine |
| Formula: | C9 H14 N4 O |
| Formal charge: | 0 |
| Formula weight: | 194.234 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 4-methoxy-2-(piperazin-1-yl)pyrimidine |
| OpenEye OEToolkits | 2.0.7 | 4-methoxy-2-piperazin-1-yl-pyrimidine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | COc1nc(ncc1)N1CCNCC1 |
| InChI | InChI | 1.06 | InChI=1S/C9H14N4O/c1-14-8-2-3-11-9(12-8)13-6-4-10-5-7-13/h2-3,10H,4-7H2,1H3 |
| InChIKey | InChI | 1.06 | UWNRWWIRIZDKLH-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COc1ccnc(n1)N2CCNCC2 |
| SMILES | CACTVS | 3.385 | COc1ccnc(n1)N2CCNCC2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | COc1ccnc(n1)N2CCNCC2 |
| SMILES | OpenEye OEToolkits | 2.0.7 | COc1ccnc(n1)N2CCNCC2 |
