WZ7
Summary
| Name: | 2-[(cyclopent-3-en-1-yl)amino]pyridine-4-carboxamide |
| Formula: | C11 H13 N3 O |
| Formal charge: | 0 |
| Formula weight: | 203.24 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 2-[(cyclopent-3-en-1-yl)amino]pyridine-4-carboxamide |
| OpenEye OEToolkits | 2.0.7 | 2-(cyclopent-3-en-1-ylamino)pyridine-4-carboxamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | c2cnc(NC1CC=CC1)cc2C(=O)N |
| InChI | InChI | 1.03 | InChI=1S/C11H13N3O/c12-11(15)8-5-6-13-10(7-8)14-9-3-1-2-4-9/h1-2,5-7,9H,3-4H2,(H2,12,15)(H,13,14) |
| InChIKey | InChI | 1.03 | NDEZMUYBKJXUGJ-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | NC(=O)c1ccnc(NC2CC=CC2)c1 |
| SMILES | CACTVS | 3.385 | NC(=O)c1ccnc(NC2CC=CC2)c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cnc(cc1C(=O)N)NC2CC=CC2 |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1cnc(cc1C(=O)N)NC2CC=CC2 |
