N2-(4-azanylcyclohexyl)-N6-(4-butylpiperidin-1-yl)-9-cyclopentyl-purine-2,6-diamine; N-propylpropan-1-amine

Systemtic Name: N2-(4-azanylcyclohexyl)-N6-(4-butylpiperidin-1-yl)-9-cyclopentyl-purine-2,6-diamine; N-propylpropan-1-amine Openeye Name: N2-(4-aminocyclohexyl)-N6-(4-butyl-1-piperidyl)-9-cyclopentyl-purine-2,6-diamine; N-propylpropan-1-amine CAS Name: N2-(4-aminocyclohexyl)-N6-(4-butyl-1-piperidinyl)-9-cyclopentylpurine-2,6-diamine; N-propyl-1-propanamine IUPAC Name: 2-N-(4-aminocyclohexyl)-6-N-(4-butylpiperidin-1-yl)-9-cyclopentylpurine-2,6-diamine; N-propylpropan-1-amine Traditional Name: (4-aminocyclohexyl)-[6-[(4-butylpiperidino)amino]-9-cyclopentyl-purin-2-yl]amine; dipropylamine Formula: C31H57N9 MolecularWeight: 555.84458

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCN(CC1)NC2=NC(=NC3=C2N=CN3C4CCCC4)NC5CCC(CC5)N.CCCNCCC

Isomeric SMILES

CCCCC1CCN(CC1)NC2=NC(=NC3=C2N=CN3C4CCCC4)NC5CCC(CC5)N.CCCNCCC

InChI

InChI=1S/C25H42N8.C6H15N/c1-2-3-6-18-13-15-32(16-14-18)31-23-22-24(33(17-27-22)21-7-4-5-8-21)30-25(29-23)28-20-11-9-19(26)10-12-20;1-3-5-7-6-4-2/h17-21H,2-16,26H2,1H3,(H2,28,29,30,31);7H,3-6H2,1-2H3