N-[(1R)-1-(4-methyl-2-pyridin-4-yl-pyrimidin-5-yl)ethyl]-1-propan-2-yl-piperidin-1-ium-4-amine

Systemtic Name: N-[(1R)-1-(4-methyl-2-pyridin-4-yl-pyrimidin-5-yl)ethyl]-1-propan-2-yl-piperidin-1-ium-4-amine Openeye Name: 1-isopropyl-N-[(1R)-1-[4-methyl-2-(4-pyridyl)pyrimidin-5-yl]ethyl]piperidin-1-ium-4-amine CAS Name: N-[(1R)-1-(4-methyl-2-pyridin-4-yl-5-pyrimidinyl)ethyl]-1-propan-2-yl-4-piperidin-1-iumamine IUPAC Name: N-[(1R)-1-(4-methyl-2-pyridin-4-ylpyrimidin-5-yl)ethyl]-1-propan-2-ylpiperidin-1-ium-4-amine Traditional Name: (1-isopropylpiperidin-1-ium-4-yl)-[(1R)-1-[4-methyl-2-(4-pyridyl)pyrimidin-5-yl]ethyl]amine Formula: C20H30N5+ MolecularWeight: 340.4857

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1C(C)NC2CC[NH+](CC2)C(C)C)C3=CC=NC=C3

Isomeric SMILES

CC1=NC(=NC=C1[C@@H](C)NC2CC[NH+](CC2)C(C)C)C3=CC=NC=C3

InChI

InChI=1S/C20H29N5/c1-14(2)25-11-7-18(8-12-25)23-15(3)19-13-22-20(24-16(19)4)17-5-9-21-10-6-17/h5-6,9-10,13-15,18,23H,7-8,11-12H2,1-4H3/p+1/t15-/m1/s1