A1AJQ
Summary
| Name: | 4-(piperazin-1-yl)quinoline |
| Formula: | C13 H15 N3 |
| Formal charge: | 0 |
| Formula weight: | 213.278 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 4-(piperazin-1-yl)quinoline |
| OpenEye OEToolkits | 2.0.7 | 4-piperazin-1-ylquinoline |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | c1cc(c2ccccc2n1)N1CCNCC1 |
| InChI | InChI | 1.06 | InChI=1S/C13H15N3/c1-2-4-12-11(3-1)13(5-6-15-12)16-9-7-14-8-10-16/h1-6,14H,7-10H2 |
| InChIKey | InChI | 1.06 | CGSWRHKBLLDUHO-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | C1CN(CCN1)c2ccnc3ccccc23 |
| SMILES | CACTVS | 3.385 | C1CN(CCN1)c2ccnc3ccccc23 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccc2c(c1)c(ccn2)N3CCNCC3 |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1ccc2c(c1)c(ccn2)N3CCNCC3 |
