A1B0N
Summary
| Name: | 2-(1H-pyrrol-1-yl)pyridin-3-amine |
| Formula: | C9 H9 N3 |
| Formal charge: | 0 |
| Formula weight: | 159.188 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 14.52 | 2-(1H-pyrrol-1-yl)pyridin-3-amine |
| OpenEye OEToolkits | 3.1.0.0 | 2-pyrrol-1-ylpyridin-3-amine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | Nc1cccnc1n1cccc1 |
| InChI | InChI | 1.06 | InChI=1S/C9H9N3/c10-8-4-3-5-11-9(8)12-6-1-2-7-12/h1-7H,10H2 |
| InChIKey | InChI | 1.06 | QCTDPVKLZRURRV-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Nc1cccnc1n2cccc2 |
| SMILES | CACTVS | 3.385 | Nc1cccnc1n2cccc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | c1ccn(c1)c2c(cccn2)N |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | c1ccn(c1)c2c(cccn2)N |
