CJ9
Summary
Name: | N4-cyclopropyl-6-piperidin-1-yl-pyrimidine-2,4-diamine |
Formula: | C12 H19 N5 |
Formal charge: | 0 |
Formula weight: | 233.313 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.6 | ~{N}4-cyclopropyl-6-piperidin-1-yl-pyrimidine-2,4-diamine |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C12H19N5/c13-12-15-10(14-9-4-5-9)8-11(16-12)17-6-2-1-3-7-17/h8-9H,1-7H2,(H3,13,14,15,16) |
InChIKey | InChI | 1.03 | KEJKDPAZBYTTRQ-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | Nc1nc(NC2CC2)cc(n1)N3CCCCC3 |
SMILES | CACTVS | 3.385 | Nc1nc(NC2CC2)cc(n1)N3CCCCC3 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1c(nc(nc1N2CCCCC2)N)NC3CC3 |
SMILES | OpenEye OEToolkits | 2.0.6 | c1c(nc(nc1N2CCCCC2)N)NC3CC3 |