A1BFA
Summary
| Name: | 4-acetylpiperazine-1-carboxamide |
| Formula: | C7 H13 N3 O2 |
| Formal charge: | 0 |
| Formula weight: | 171.197 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 14.52 | 4-acetylpiperazine-1-carboxamide |
| OpenEye OEToolkits | 3.1.0.0 | 4-ethanoylpiperazine-1-carboxamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | O=C(N)N1CCN(CC1)C(C)=O |
| InChI | InChI | 1.06 | InChI=1S/C7H13N3O2/c1-6(11)9-2-4-10(5-3-9)7(8)12/h2-5H2,1H3,(H2,8,12) |
| InChIKey | InChI | 1.06 | DBVCCTKTVHHAAW-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC(=O)N1CCN(CC1)C(N)=O |
| SMILES | CACTVS | 3.385 | CC(=O)N1CCN(CC1)C(N)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | CC(=O)N1CCN(CC1)C(=O)N |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | CC(=O)N1CCN(CC1)C(=O)N |
