A1BDL
Summary
| Name: | 3-[(1H-pyrrol-1-yl)methyl]pyridine |
| Formula: | C10 H10 N2 |
| Formal charge: | 0 |
| Formula weight: | 158.2 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 14.52 | 3-[(1H-pyrrol-1-yl)methyl]pyridine |
| OpenEye OEToolkits | 3.1.0.0 | 3-(pyrrol-1-ylmethyl)pyridine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | n1cc(Cn2cccc2)ccc1 |
| InChI | InChI | 1.06 | InChI=1S/C10H10N2/c1-2-7-12(6-1)9-10-4-3-5-11-8-10/h1-8H,9H2 |
| InChIKey | InChI | 1.06 | PJVWPGGKILHMKW-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | C(n1cccc1)c2cccnc2 |
| SMILES | CACTVS | 3.385 | C(n1cccc1)c2cccnc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | c1ccn(c1)Cc2cccnc2 |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | c1ccn(c1)Cc2cccnc2 |
