[4-methyl-1-(4-pyrimidin-2-ylpiperazin-1-yl)cyclohexyl]methylazanium

Systemtic Name: [4-methyl-1-(4-pyrimidin-2-ylpiperazin-1-yl)cyclohexyl]methylazanium Openeye Name: [4-methyl-1-(4-pyrimidin-2-ylpiperazin-1-yl)cyclohexyl]methylammonium CAS Name: [4-methyl-1-[4-(2-pyrimidinyl)-1-piperazinyl]cyclohexyl]methylammonium IUPAC Name: [4-methyl-1-(4-pyrimidin-2-ylpiperazin-1-yl)cyclohexyl]methylazanium Traditional Name: [4-methyl-1-[4-(2-pyrimidyl)piperazino]cyclohexyl]methylammonium Formula: C16H28N5+ MolecularWeight: 290.42702

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)(C[NH3+])N2CCN(CC2)C3=NC=CC=N3

Isomeric SMILES

CC1CCC(CC1)(C[NH3+])N2CCN(CC2)C3=NC=CC=N3

InChI

InChI=1S/C16H27N5/c1-14-3-5-16(13-17,6-4-14)21-11-9-20(10-12-21)15-18-7-2-8-19-15/h2,7-8,14H,3-6,9-13,17H2,1H3/p+1