C4E
Summary
| Name: | N-phenyl-1H-pyrrolo[2,3-b]pyridin-3-amine |
| Formula: | C13 H11 N3 |
| Formal charge: | 0 |
| Formula weight: | 209.247 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | N-phenyl-1H-pyrrolo[2,3-b]pyridin-3-amine |
| OpenEye OEToolkits | 1.5.0 | N-phenyl-1H-pyrrolo[5,4-b]pyridin-3-amine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | n1cccc2c1ncc2Nc3ccccc3 |
| SMILES_CANONICAL | CACTVS | 3.341 | [nH]1cc(Nc2ccccc2)c3cccnc13 |
| SMILES | CACTVS | 3.341 | [nH]1cc(Nc2ccccc2)c3cccnc13 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1ccc(cc1)Nc2c[nH]c3c2cccn3 |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1ccc(cc1)Nc2c[nH]c3c2cccn3 |
| InChI | InChI | 1.03 | InChI=1S/C13H11N3/c1-2-5-10(6-3-1)16-12-9-15-13-11(12)7-4-8-14-13/h1-9,16H,(H,14,15) |
| InChIKey | InChI | 1.03 | CQFGXDQUQWRXLE-UHFFFAOYSA-N |
