LD4
Summary
| Name: | N-cycloheptylpyrimidin-2-amine |
| Formula: | C11 H17 N3 |
| Formal charge: | 0 |
| Formula weight: | 191.273 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | N-cycloheptylpyrimidin-2-amine |
| OpenEye OEToolkits | 2.0.6 | ~{N}-cycloheptylpyrimidin-2-amine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | n1c(nccc1)NC2CCCCCC2 |
| InChI | InChI | 1.03 | InChI=1S/C11H17N3/c1-2-4-7-10(6-3-1)14-11-12-8-5-9-13-11/h5,8-10H,1-4,6-7H2,(H,12,13,14) |
| InChIKey | InChI | 1.03 | DYFJUGGWBNHTMD-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | C1CCCC(CC1)Nc2ncccn2 |
| SMILES | CACTVS | 3.385 | C1CCCC(CC1)Nc2ncccn2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1cnc(nc1)NC2CCCCCC2 |
| SMILES | OpenEye OEToolkits | 2.0.6 | c1cnc(nc1)NC2CCCCCC2 |
