W1A
Summary
| Name: | N-[(piperidin-4-yl)methyl]methanesulfonamide |
| Formula: | C7 H16 N2 O2 S |
| Formal charge: | 0 |
| Formula weight: | 192.279 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | N-[(piperidin-4-yl)methyl]methanesulfonamide |
| OpenEye OEToolkits | 2.0.7 | ~{N}-(piperidin-4-ylmethyl)methanesulfonamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | N1CCC(CC1)CNS(=O)(=O)C |
| InChI | InChI | 1.03 | InChI=1S/C7H16N2O2S/c1-12(10,11)9-6-7-2-4-8-5-3-7/h7-9H,2-6H2,1H3 |
| InChIKey | InChI | 1.03 | LULUGSQUPICPQM-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | C[S](=O)(=O)NCC1CCNCC1 |
| SMILES | CACTVS | 3.385 | C[S](=O)(=O)NCC1CCNCC1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CS(=O)(=O)NCC1CCNCC1 |
| SMILES | OpenEye OEToolkits | 2.0.7 | CS(=O)(=O)NCC1CCNCC1 |
