5-[[(1-cyclopentylpiperidin-3-yl)methyl-(2-piperidin-1-ylethyl)amino]methyl]pyrimidin-2-amine

Systemtic Name: 5-[[(1-cyclopentylpiperidin-3-yl)methyl-(2-piperidin-1-ylethyl)amino]methyl]pyrimidin-2-amine Openeye Name: 5-[[(1-cyclopentyl-3-piperidyl)methyl-[2-(1-piperidyl)ethyl]amino]methyl]pyrimidin-2-amine CAS Name: 5-[[(1-cyclopentyl-3-piperidinyl)methyl-[2-(1-piperidinyl)ethyl]amino]methyl]-2-pyrimidinamine IUPAC Name: 5-[[(1-cyclopentylpiperidin-3-yl)methyl-(2-piperidin-1-ylethyl)amino]methyl]pyrimidin-2-amine Traditional Name: (2-aminopyrimidin-5-yl)methyl-[(1-cyclopentyl-3-piperidyl)methyl]-(2-piperidinoethyl)amine Formula: C23H40N6 MolecularWeight: 400.6039

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCN(CC2CCCN(C2)C3CCCC3)CC4=CN=C(N=C4)N

Isomeric SMILES

C1CCN(CC1)CCN(CC2CCCN(C2)C3CCCC3)CC4=CN=C(N=C4)N

InChI

InChI=1S/C23H40N6/c24-23-25-15-21(16-26-23)18-28(14-13-27-10-4-1-5-11-27)17-20-7-6-12-29(19-20)22-8-2-3-9-22/h15-16,20,22H,1-14,17-19H2,(H2,24,25,26)