4-[(2S,6R)-4-fluoranyl-2,6-bis(3-methylpyridin-2-yl)piperidin-1-yl]butan-1-amine

Systemtic Name: 4-[(2S,6R)-4-fluoranyl-2,6-bis(3-methylpyridin-2-yl)piperidin-1-yl]butan-1-amine Openeye Name: 4-[(2S,6R)-4-fluoro-2,6-bis(3-methyl-2-pyridyl)-1-piperidyl]butan-1-amine CAS Name: 4-[(2S,6R)-4-fluoro-2,6-bis(3-methyl-2-pyridinyl)-1-piperidinyl]-1-butanamine IUPAC Name: 4-[(2S,6R)-4-fluoro-2,6-bis(3-methylpyridin-2-yl)piperidin-1-yl]butan-1-amine Traditional Name: 4-[(2S,6R)-4-fluoro-2,6-bis(3-methyl-2-pyridyl)piperidino]butylamine Formula: C21H29FN4 MolecularWeight: 356.480163

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CC=C1)C2CC(CC(N2CCCCN)C3=C(C=CC=N3)C)F

Isomeric SMILES

CC1=C(N=CC=C1)[C@H]2CC(C[C@H](N2CCCCN)C3=C(C=CC=N3)C)F

InChI

InChI=1S/C21H29FN4/c1-15-7-5-10-24-20(15)18-13-17(22)14-19(26(18)12-4-3-9-23)21-16(2)8-6-11-25-21/h5-8,10-11,17-19H,3-4,9,12-14,23H2,1-2H3/t17?,18-,19+