WJM
Summary
| Name: | 2-[4-(furan-2-carbonyl)piperazin-1-yl]acetamide |
| Formula: | C11 H15 N3 O3 |
| Formal charge: | 0 |
| Formula weight: | 237.255 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 2-[4-(furan-2-carbonyl)piperazin-1-yl]acetamide |
| OpenEye OEToolkits | 2.0.7 | 2-[4-(furan-2-ylcarbonyl)piperazin-1-yl]ethanamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | N1(CCN(CC1)C(=O)c2ccco2)CC(N)=O |
| InChI | InChI | 1.03 | InChI=1S/C11H15N3O3/c12-10(15)8-13-3-5-14(6-4-13)11(16)9-2-1-7-17-9/h1-2,7H,3-6,8H2,(H2,12,15) |
| InChIKey | InChI | 1.03 | ZHALJTYSCWNFOY-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | NC(=O)CN1CCN(CC1)C(=O)c2occc2 |
| SMILES | CACTVS | 3.385 | NC(=O)CN1CCN(CC1)C(=O)c2occc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc(oc1)C(=O)N2CCN(CC2)CC(=O)N |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1cc(oc1)C(=O)N2CCN(CC2)CC(=O)N |
