N-[4-[(3R,4R,5S)-3-azanyl-5-methyl-4-oxidanyl-piperidin-1-yl]pyridin-3-yl]-6-cyclohexyl-5-fluoranyl-pyridine-2-carboxamide

Systemtic Name: N-[4-[(3R,4R,5S)-3-azanyl-5-methyl-4-oxidanyl-piperidin-1-yl]pyridin-3-yl]-6-cyclohexyl-5-fluoranyl-pyridine-2-carboxamide Openeye Name: N-[4-[(3R,4R,5S)-3-amino-4-hydroxy-5-methyl-1-piperidyl]-3-pyridyl]-6-cyclohexyl-5-fluoro-pyridine-2-carboxamide CAS Name: N-[4-[(3R,4R,5S)-3-amino-4-hydroxy-5-methyl-1-piperidinyl]-3-pyridinyl]-6-cyclohexyl-5-fluoro-2-pyridinecarboxamide IUPAC Name: N-[4-[(3R,4R,5S)-3-amino-4-hydroxy-5-methylpiperidin-1-yl]pyridin-3-yl]-6-cyclohexyl-5-fluoropyridine-2-carboxamide Traditional Name: N-[4-[(3R,4R,5S)-3-amino-4-hydroxy-5-methyl-piperidino]-3-pyridyl]-6-cyclohexyl-5-fluoro-picolinamide Formula: C23H30FN5O2 MolecularWeight: 427.515003

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(C1O)N)C2=C(C=NC=C2)NC(=O)C3=NC(=C(C=C3)F)C4CCCCC4

Isomeric SMILES

C[C@H]1CN(C[C@H]([C@@H]1O)N)C2=C(C=NC=C2)NC(=O)C3=NC(=C(C=C3)F)C4CCCCC4

InChI

InChI=1S/C23H30FN5O2/c1-14-12-29(13-17(25)22(14)30)20-9-10-26-11-19(20)28-23(31)18-8-7-16(24)21(27-18)15-5-3-2-4-6-15/h7-11,14-15,17,22,30H,2-6,12-13,25H2,1H3,(H,28,31)/t14-,17+,22+/m0/s1