5HQ
Summary
| Name: | 1-[6-(furan-2-yl)pyridin-3-yl]methanamine |
| Formula: | C10 H10 N2 O |
| Formal charge: | 0 |
| Formula weight: | 174.199 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 1-[6-(furan-2-yl)pyridin-3-yl]methanamine |
| OpenEye OEToolkits | 1.9.2 | [6-(furan-2-yl)pyridin-3-yl]methanamine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | c2(c1occc1)ncc(CN)cc2 |
| InChI | InChI | 1.03 | InChI=1S/C10H10N2O/c11-6-8-3-4-9(12-7-8)10-2-1-5-13-10/h1-5,7H,6,11H2 |
| InChIKey | InChI | 1.03 | WEPDEUMTQHBFOQ-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | NCc1ccc(nc1)c2occc2 |
| SMILES | CACTVS | 3.385 | NCc1ccc(nc1)c2occc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | c1cc(oc1)c2ccc(cn2)CN |
| SMILES | OpenEye OEToolkits | 1.9.2 | c1cc(oc1)c2ccc(cn2)CN |
