AN5
Summary
| Name: | 5-amino-1-pyridin-3-ylpentan-1-one |
| Formula: | C10 H14 N2 O |
| Formal charge: | 0 |
| Formula weight: | 178.231 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 5-amino-1-pyridin-3-ylpentan-1-one |
| OpenEye OEToolkits | 1.6.1 | 5-amino-1-pyridin-3-yl-pentan-1-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(c1cccnc1)CCCCN |
| SMILES_CANONICAL | CACTVS | 3.352 | NCCCCC(=O)c1cccnc1 |
| SMILES | CACTVS | 3.352 | NCCCCC(=O)c1cccnc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.6.1 | c1cc(cnc1)C(=O)CCCCN |
| SMILES | OpenEye OEToolkits | 1.6.1 | c1cc(cnc1)C(=O)CCCCN |
| InChI | InChI | 1.03 | InChI=1S/C10H14N2O/c11-6-2-1-5-10(13)9-4-3-7-12-8-9/h3-4,7-8H,1-2,5-6,11H2 |
| InChIKey | InChI | 1.03 | GSEJHUSUJYZWBW-UHFFFAOYSA-N |
