05T
Summary
| Name: | 1-[4-(aminomethyl)cyclohexyl]guanidine |
| Formula: | C8 H18 N4 |
| Formal charge: | 0 |
| Formula weight: | 170.255 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 1-[trans-4-(aminomethyl)cyclohexyl]guanidine |
| OpenEye OEToolkits | 1.9.2 | 1-[4-(aminomethyl)cyclohexyl]guanidine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | [N@H]=C(N)NC1CCC(CC1)CN |
| InChI | InChI | 1.03 | InChI=1S/C8H18N4/c9-5-6-1-3-7(4-2-6)12-8(10)11/h6-7H,1-5,9H2,(H4,10,11,12)/t6-,7- |
| InChIKey | InChI | 1.03 | NRPMCWSMDJQOJE-LJGSYFOKSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | NC[C@H]1CC[C@@H](CC1)NC(N)=N |
| SMILES | CACTVS | 3.385 | NC[CH]1CC[CH](CC1)NC(N)=N |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | [H]/N=C(\N)/NC1CCC(CC1)CN |
| SMILES | OpenEye OEToolkits | 1.9.2 | C1CC(CCC1CN)NC(=N)N |
