WHG
Summary
| Name: | 1-[(1,2-oxazol-3-yl)methyl]piperazine |
| Formula: | C8 H13 N3 O |
| Formal charge: | 0 |
| Formula weight: | 167.208 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 1-[(1,2-oxazol-3-yl)methyl]piperazine |
| OpenEye OEToolkits | 2.0.7 | 3-(piperazin-1-ylmethyl)-1,2-oxazole |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | N2CCN(Cc1ccon1)CC2 |
| InChI | InChI | 1.03 | InChI=1S/C8H13N3O/c1-6-12-10-8(1)7-11-4-2-9-3-5-11/h1,6,9H,2-5,7H2 |
| InChIKey | InChI | 1.03 | VJMTXOUUYNPWLF-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | C1CN(CCN1)Cc2ccon2 |
| SMILES | CACTVS | 3.385 | C1CN(CCN1)Cc2ccon2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1conc1CN2CCNCC2 |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1conc1CN2CCNCC2 |
