N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]pyrimidin-2-amine

Systemtic Name: N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]pyrimidin-2-amine Openeye Name: N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]pyrimidin-2-amine CAS Name: N-[3-[(2S)-2-methyl-1-piperidin-1-iumyl]propyl]-2-pyrimidinamine IUPAC Name: N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]pyrimidin-2-amine Traditional Name: 3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl-(2-pyrimidyl)amine Formula: C13H23N4+ MolecularWeight: 235.34852

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CCCNC2=NC=CC=N2

Isomeric SMILES

C[C@H]1CCCC[NH+]1CCCNC2=NC=CC=N2

InChI

InChI=1S/C13H22N4/c1-12-6-2-3-10-17(12)11-5-9-16-13-14-7-4-8-15-13/h4,7-8,12H,2-3,5-6,9-11H2,1H3,(H,14,15,16)/p+1/t12-/m0/s1