WLA
Summary
| Name: | 1-[(oxan-4-yl)methyl]piperazine |
| Formula: | C10 H20 N2 O |
| Formal charge: | 0 |
| Formula weight: | 184.279 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 1-[(oxan-4-yl)methyl]piperazine |
| OpenEye OEToolkits | 2.0.7 | 1-(oxan-4-ylmethyl)piperazine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | C1CN(CCN1)CC2CCOCC2 |
| InChI | InChI | 1.03 | InChI=1S/C10H20N2O/c1-7-13-8-2-10(1)9-12-5-3-11-4-6-12/h10-11H,1-9H2 |
| InChIKey | InChI | 1.03 | XVQLGUIPBIHANF-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | C1CN(CCN1)CC2CCOCC2 |
| SMILES | CACTVS | 3.385 | C1CN(CCN1)CC2CCOCC2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | C1COCCC1CN2CCNCC2 |
| SMILES | OpenEye OEToolkits | 2.0.7 | C1COCCC1CN2CCNCC2 |
