42C
Summary
| Name: | N,N-dimethyl-7H-purin-6-amine |
| Formula: | C7 H9 N5 |
| Formal charge: | 0 |
| Formula weight: | 163.18 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | N,N-dimethyl-7H-purin-6-amine |
| OpenEye OEToolkits | 1.5.0 | N,N-dimethyl-7H-purin-6-amine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | n1c(c2c(nc1)ncn2)N(C)C |
| SMILES_CANONICAL | CACTVS | 3.341 | CN(C)c1ncnc2nc[nH]c12 |
| SMILES | CACTVS | 3.341 | CN(C)c1ncnc2nc[nH]c12 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CN(C)c1c2c(nc[nH]2)ncn1 |
| SMILES | OpenEye OEToolkits | 1.5.0 | CN(C)c1c2c(nc[nH]2)ncn1 |
| InChI | InChI | 1.03 | InChI=1S/C7H9N5/c1-12(2)7-5-6(9-3-8-5)10-4-11-7/h3-4H,1-2H3,(H,8,9,10,11) |
| InChIKey | InChI | 1.03 | BVIAOQMSVZHOJM-UHFFFAOYSA-N |
