1FP
Summary
| Name: | piperazine-1-carbaldehyde |
| Formula: | C5 H10 N2 O |
| Formal charge: | 0 |
| Formula weight: | 114.146 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | piperazine-1-carbaldehyde |
| OpenEye OEToolkits | 1.7.0 | piperazine-1-carbaldehyde |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=CN1CCNCC1 |
| SMILES_CANONICAL | CACTVS | 3.370 | O=CN1CCNCC1 |
| SMILES | CACTVS | 3.370 | O=CN1CCNCC1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | C1CN(CCN1)C=O |
| SMILES | OpenEye OEToolkits | 1.7.0 | C1CN(CCN1)C=O |
| InChI | InChI | 1.03 | InChI=1S/C5H10N2O/c8-5-7-3-1-6-2-4-7/h5-6H,1-4H2 |
| InChIKey | InChI | 1.03 | MSSDTZLYNMFTKN-UHFFFAOYSA-N |
