4GS
Summary
| Name: | 4-amino-N-(piperidin-4-yl)-1,2,5-oxadiazole-3-carboxamide |
| Formula: | C8 H13 N5 O2 |
| Formal charge: | 0 |
| Formula weight: | 211.221 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 4-amino-N-(piperidin-4-yl)-1,2,5-oxadiazole-3-carboxamide |
| OpenEye OEToolkits | 1.9.2 | 4-azanyl-N-piperidin-4-yl-1,2,5-oxadiazole-3-carboxamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | c1(c(non1)N)C(=O)NC2CCNCC2 |
| InChI | InChI | 1.03 | InChI=1S/C8H13N5O2/c9-7-6(12-15-13-7)8(14)11-5-1-3-10-4-2-5/h5,10H,1-4H2,(H2,9,13)(H,11,14) |
| InChIKey | InChI | 1.03 | LGMVLTCRFMCVHB-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Nc1nonc1C(=O)NC2CCNCC2 |
| SMILES | CACTVS | 3.385 | Nc1nonc1C(=O)NC2CCNCC2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | C1CNCCC1NC(=O)c2c(non2)N |
| SMILES | OpenEye OEToolkits | 1.9.2 | C1CNCCC1NC(=O)c2c(non2)N |
