K2M
Summary
| Name: | 4-(furan-2-carbonyl)piperazine-1-carboxamide |
| Formula: | C10 H13 N3 O3 |
| Formal charge: | 0 |
| Formula weight: | 223.229 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 4-(furan-2-carbonyl)piperazine-1-carboxamide |
| OpenEye OEToolkits | 2.0.6 | 4-(furan-2-ylcarbonyl)piperazine-1-carboxamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | N2(CCN(C(=O)c1occc1)CC2)C(N)=O |
| InChI | InChI | 1.03 | InChI=1S/C10H13N3O3/c11-10(15)13-5-3-12(4-6-13)9(14)8-2-1-7-16-8/h1-2,7H,3-6H2,(H2,11,15) |
| InChIKey | InChI | 1.03 | TWRIXENNPDTMSQ-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | NC(=O)N1CCN(CC1)C(=O)c2occc2 |
| SMILES | CACTVS | 3.385 | NC(=O)N1CCN(CC1)C(=O)c2occc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1cc(oc1)C(=O)N2CCN(CC2)C(=O)N |
| SMILES | OpenEye OEToolkits | 2.0.6 | c1cc(oc1)C(=O)N2CCN(CC2)C(=O)N |
