LCU
Summary
| Name: | 2-[(1R,3s,5S)-bicyclo[3.1.0]hexan-3-yl]-N-(4-methylpyridin-3-yl)acetamide |
| Formula: | C14 H18 N2 O |
| Formal charge: | 0 |
| Formula weight: | 230.306 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 2-[(1R,3s,5S)-bicyclo[3.1.0]hexan-3-yl]-N-(4-methylpyridin-3-yl)acetamide |
| OpenEye OEToolkits | 2.0.7 | 2-[(1~{S},5~{R})-3-bicyclo[3.1.0]hexanyl]-~{N}-(4-methylpyridin-3-yl)ethanamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(Nc1cnccc1C)CC1CC2CC2C1 |
| InChI | InChI | 1.06 | InChI=1S/C14H18N2O/c1-9-2-3-15-8-13(9)16-14(17)6-10-4-11-7-12(11)5-10/h2-3,8,10-12H,4-7H2,1H3,(H,16,17)/t10-,11+,12- |
| InChIKey | InChI | 1.06 | WEHZCBNACMTKKE-ZSBIGDGJSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cc1ccncc1NC(=O)CC2C[C@@H]3C[C@@H]3C2 |
| SMILES | CACTVS | 3.385 | Cc1ccncc1NC(=O)CC2C[CH]3C[CH]3C2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cc1ccncc1NC(=O)CC2C[C@H]3C[C@H]3C2 |
| SMILES | OpenEye OEToolkits | 2.0.7 | Cc1ccncc1NC(=O)CC2CC3CC3C2 |
