2-[3-(difluoromethyl)phenyl]-1-[3-[5-(3-hydroxyoxetan-3-yl)-6-methoxy-3-pyridinyl]-4-methylphenyl]ethanone;N-[5-[6-(2-hydroxyethoxy)-5-(3-methyloxetan-3-yl)pyridazin-3-yl]-6-methyl-3-pyridinyl]-3-(trifluoromethyl)benzamide;N-[3-[3-methoxy-5-(oxetan-3-yl)phenyl]-4-methylphenyl]-3-(trifluoromethyl)benzamide;N-[5-[3-methoxy-5-(oxetan-3-yl)phenyl]-6-methyl-3-pyridinyl]-3-(trifluoromethyl)benzamide;N-[6-methyl-5-[3-(3-methyloxetan-3-yl)phenyl]-3-pyridinyl]-3-(trifluoromethyl)benzamide;N-[6-methyl-5-[3-(oxetan-3-yl)phenyl]-3-pyridinyl]-3-(trifluoromethyl)benzamide

C145H129F17N12O18 — CID 158499476

IUPAC2-[3-(difluoromethyl)phenyl]-1-[3-[5-(3-hydroxyoxetan-3-yl)-6-methoxy-3-pyridinyl]-4-methylphenyl]ethanone;N-[5-[6-(2-hydroxyethoxy)-5-(3-methyloxetan-3-yl)pyridazin-3-yl]-6-methyl-3-pyridinyl]-3-(trifluoromethyl)benzamide;N-[3-[3-methoxy-5-(oxetan-3-yl)phenyl]-4-methylphenyl]-3-(trifluoromethyl)benzamide;N-[5-[3-methoxy-5-(oxetan-3-yl)phenyl]-6-methyl-3-pyridinyl]-3-(trifluoromethyl)benzamide;N-[6-methyl-5-[3-(3-methyloxetan-3-yl)phenyl]-3-pyridinyl]-3-(trifluoromethyl)benzamide;N-[6-methyl-5-[3-(oxetan-3-yl)phenyl]-3-pyridinyl]-3-(trifluoromethyl)benzamide
SMILESCOc1cc(-c2cc(NC(=O)c3cccc(C(F)(F)F)c3)ccc2C)cc(C2COC2)c1.COc1cc(-c2cc(NC(=O)c3cccc(C(F)(F)F)c3)cnc2C)cc(C2COC2)c1.COc1ncc(-c2cc(C(=O)Cc3cccc(C(F)F)c3)ccc2C)cc1C1(O)COC1.Cc1ncc(NC(=O)c2cccc(C(F)(F)F)c2)cc1-c1cc(C2(C)COC2)c(OCCO)nn1.Cc1ncc(NC(=O)c2cccc(C(F)(F)F)c2)cc1-c1cccc(C2(C)COC2)c1.Cc1ncc(NC(=O)c2cccc(C(F)(F)F)c2)cc1-c1cccc(C2COC2)c1
InChIInChI=1S/C25H22F3NO3.C25H23F2NO4.C24H23F3N4O4.C24H21F3N2O3.C24H21F3N2O2.C23H19F3N2O2/c1-15-6-7-21(29-24(30)16-4-3-5-20(9-16)25(26,27)28)12-23(15)18-8-17(19-13-32-14-19)10-22(11-18)31-2;1-15-6-7-17(22(29)9-16-4-3-5-18(8-16)23(26)27)10-20(15)19-11-21(24(31-2)28-12-19)25(30)13-32-14-25;1-14-18(20-10-19(23(2)12-34-13-23)22(31-30-20)35-7-6-32)9-17(11-28-14)29-21(33)15-4-3-5-16(8-15)24(25,26)27;1-14-22(17-6-16(18-12-32-13-18)8-21(9-17)31-2)10-20(11-28-14)29-23(30)15-4-3-5-19(7-15)24(25,26)27;1-15-21(16-5-3-7-18(9-16)23(2)13-31-14-23)11-20(12-28-15)29-22(30)17-6-4-8-19(10-17)24(25,26)27;1-14-21(16-5-2-4-15(8-16)18-12-30-13-18)10-20(11-27-14)28-22(29)17-6-3-7-19(9-17)23(24,25)26/h3-12,19H,13-14H2,1-2H3,(H,29,30);3-8,10-12,23,30H,9,13-14H2,1-2H3;3-5,8-11,32H,6-7,12-13H2,1-2H3,(H,29,33);3-11,18H,12-13H2,1-2H3,(H,29,30);3-12H,13-14H2,1-2H3,(H,29,30);2-11,18H,12-13H2,1H3,(H,28,29)
InChIKeyHJSCEYAOBBUFRT-UHFFFAOYSA-N
MW2650.66 g/mol
LogP30.99
Rot. Bonds32

About 2-[3-(difluoromethyl)phenyl]-1-[3-[5-(3-hydroxyoxetan-3-yl)-6-methoxy-3-pyridinyl]-4-methylphenyl]ethanone;N-[5-[6-(2-hydroxyethoxy)-5-(3-methyloxetan-3-yl)pyridazin-3-yl]-6-methyl-3-pyridinyl]-3-(trifluoromethyl)benzamide;N-[3-[3-methoxy-5-(oxetan-3-yl)phenyl]-4-methylphenyl]-3-(trifluoromethyl)benzamide;N-[5-[3-methoxy-5-(oxetan-3-yl)phenyl]-6-methyl-3-pyridinyl]-3-(trifluoromethyl)benzamide;N-[6-methyl-5-[3-(3-methyloxetan-3-yl)phenyl]-3-pyridinyl]-3-(trifluoromethyl)benzamide;N-[6-methyl-5-[3-(oxetan-3-yl)phenyl]-3-pyridinyl]-3-(trifluoromethyl)benzamide

2-[3-(difluoromethyl)phenyl]-1-[3-[5-(3-hydroxyoxetan-3-yl)-6-methoxy-3-pyridinyl]-4-methylphenyl]ethanone;N-[5-[6-(2-hydroxyethoxy)-5-(3-methyloxetan-3-yl)pyridazin-3-yl]-6-methyl-3-pyridinyl]-3-(trifluoromethyl)benzamide;N-[3-[3-methoxy-5-(oxetan-3-yl)phenyl]-4-methylphenyl]-3-(trifluoromethyl)benzamide;N-[5-[3-methoxy-5-(oxetan-3-yl)phenyl]-6-methyl-3-pyridinyl]-3-(trifluoromethyl)benzamide;N-[6-methyl-5-[3-(3-methyloxetan-3-yl)phenyl]-3-pyridinyl]-3-(trifluoromethyl)benzamide;N-[6-methyl-5-[3-(oxetan-3-yl)phenyl]-3-pyridinyl]-3-(trifluoromethyl)benzamide (PubChem CID 158499476) has the molecular formula C145H129F17N12O18 and a molecular weight of 2650.66 g/mol. Its IUPAC name is 2-[3-(difluoromethyl)phenyl]-1-[3-[5-(3-hydroxyoxetan-3-yl)-6-methoxy-3-pyridinyl]-4-methylphenyl]ethanone;N-[5-[6-(2-hydroxyethoxy)-5-(3-methyloxetan-3-yl)pyridazin-3-yl]-6-methyl-3-pyridinyl]-3-(trifluoromethyl)benzamide;N-[3-[3-methoxy-5-(oxetan-3-yl)phenyl]-4-methylphenyl]-3-(trifluoromethyl)benzamide;N-[5-[3-methoxy-5-(oxetan-3-yl)phenyl]-6-methyl-3-pyridinyl]-3-(trifluoromethyl)benzamide;N-[6-methyl-5-[3-(3-methyloxetan-3-yl)phenyl]-3-pyridinyl]-3-(trifluoromethyl)benzamide;N-[6-methyl-5-[3-(oxetan-3-yl)phenyl]-3-pyridinyl]-3-(trifluoromethyl)benzamide.

Molecular Properties

Compound Name2-[3-(difluoromethyl)phenyl]-1-[3-[5-(3-hydroxyoxetan-3-yl)-6-methoxy-3-pyridinyl]-4-methylphenyl]ethanone;N-[5-[6-(2-hydroxyethoxy)-5-(3-methyloxetan-3-yl)pyridazin-3-yl]-6-methyl-3-pyridinyl]-3-(trifluoromethyl)benzamide;N-[3-[3-methoxy-5-(oxetan-3-yl)phenyl]-4-methylphenyl]-3-(trifluoromethyl)benzamide;N-[5-[3-methoxy-5-(oxetan-3-yl)phenyl]-6-methyl-3-pyridinyl]-3-(trifluoromethyl)benzamide;N-[6-methyl-5-[3-(3-methyloxetan-3-yl)phenyl]-3-pyridinyl]-3-(trifluoromethyl)benzamide;N-[6-methyl-5-[3-(oxetan-3-yl)phenyl]-3-pyridinyl]-3-(trifluoromethyl)benzamide
PubChem CID158499476
Molecular FormulaC145H129F17N12O18
Molecular Weight2650.66 g/mol
Exact Mass2648.93
IUPAC Name2-[3-(difluoromethyl)phenyl]-1-[3-[5-(3-hydroxyoxetan-3-yl)-6-methoxy-3-pyridinyl]-4-methylphenyl]ethanone;N-[5-[6-(2-hydroxyethoxy)-5-(3-methyloxetan-3-yl)pyridazin-3-yl]-6-methyl-3-pyridinyl]-3-(trifluoromethyl)benzamide;N-[3-[3-methoxy-5-(oxetan-3-yl)phenyl]-4-methylphenyl]-3-(trifluoromethyl)benzamide;N-[5-[3-methoxy-5-(oxetan-3-yl)phenyl]-6-methyl-3-pyridinyl]-3-(trifluoromethyl)benzamide;N-[6-methyl-5-[3-(3-methyloxetan-3-yl)phenyl]-3-pyridinyl]-3-(trifluoromethyl)benzamide;N-[6-methyl-5-[3-(oxetan-3-yl)phenyl]-3-pyridinyl]-3-(trifluoromethyl)benzamide
SMILESCOc1cc(-c2cc(NC(=O)c3cccc(C(F)(F)F)c3)ccc2C)cc(C2COC2)c1.COc1cc(-c2cc(NC(=O)c3cccc(C(F)(F)F)c3)cnc2C)cc(C2COC2)c1.COc1ncc(-c2cc(C(=O)Cc3cccc(C(F)F)c3)ccc2C)cc1C1(O)COC1.Cc1ncc(NC(=O)c2cccc(C(F)(F)F)c2)cc1-c1cc(C2(C)COC2)c(OCCO)nn1.Cc1ncc(NC(=O)c2cccc(C(F)(F)F)c2)cc1-c1cccc(C2(C)COC2)c1.Cc1ncc(NC(=O)c2cccc(C(F)(F)F)c2)cc1-c1cccc(C2COC2)c1
InChIInChI=1S/C25H22F3NO3.C25H23F2NO4.C24H23F3N4O4.C24H21F3N2O3.C24H21F3N2O2.C23H19F3N2O2/c1-15-6-7-21(29-24(30)16-4-3-5-20(9-16)25(26,27)28)12-23(15)18-8-17(19-13-32-14-19)10-22(11-18)31-2;1-15-6-7-17(22(29)9-16-4-3-5-18(8-16)23(26)27)10-20(15)19-11-21(24(31-2)28-12-19)25(30)13-32-14-25;1-14-18(20-10-19(23(2)12-34-13-23)22(31-30-20)35-7-6-32)9-17(11-28-14)29-21(33)15-4-3-5-16(8-15)24(25,26)27;1-14-22(17-6-16(18-12-32-13-18)8-21(9-17)31-2)10-20(11-28-14)29-23(30)15-4-3-5-19(7-15)24(25,26)27;1-15-21(16-5-3-7-18(9-16)23(2)13-31-14-23)11-20(12-28-15)29-22(30)17-6-4-8-19(10-17)24(25,26)27;1-14-21(16-5-2-4-15(8-16)18-12-30-13-18)10-20(11-27-14)28-22(29)17-6-3-7-19(9-17)23(24,25)26/h3-12,19H,13-14H2,1-2H3,(H,29,30);3-8,10-12,23,30H,9,13-14H2,1-2H3;3-5,8-11,32H,6-7,12-13H2,1-2H3,(H,29,33);3-11,18H,12-13H2,1-2H3,(H,29,30);3-12H,13-14H2,1-2H3,(H,29,30);2-11,18H,12-13H2,1H3,(H,28,29)
InChIKeyHJSCEYAOBBUFRT-UHFFFAOYSA-N
XLogP30.99
TPSA385.56 Ų
H-Bond Donors7
H-Bond Acceptors25
Rotatable Bonds32
Heavy Atoms192
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002650.66
LogP ≤ 530.99
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1025

Analyze 2-[3-(difluoromethyl)phenyl]-1-[3-[5-(3-hydroxyoxetan-3-yl)-6-methoxy-3-pyridinyl]-4-methylphenyl]ethanone;N-[5-[6-(2-hydroxyethoxy)-5-(3-methyloxetan-3-yl)pyridazin-3-yl]-6-methyl-3-pyridinyl]-3-(trifluoromethyl)benzamide;N-[3-[3-methoxy-5-(oxetan-3-yl)phenyl]-4-methylphenyl]-3-(trifluoromethyl)benzamide;N-[5-[3-methoxy-5-(oxetan-3-yl)phenyl]-6-methyl-3-pyridinyl]-3-(trifluoromethyl)benzamide;N-[6-methyl-5-[3-(3-methyloxetan-3-yl)phenyl]-3-pyridinyl]-3-(trifluoromethyl)benzamide;N-[6-methyl-5-[3-(oxetan-3-yl)phenyl]-3-pyridinyl]-3-(trifluoromethyl)benzamide with MolForge

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Launch Full Analysis

Related Compounds

N-[5-[2-[3-(fluoromethyl)oxetan-3-yl]-6-[2-[[2-[3-(3-fluorooxetan-3-yl)-5-(3-hydroxyoxetan-3-yl)phenyl]-4-[[2-(trifluoromethyl)pyridine-4-carbonyl]amino]phenyl]methoxy]ethoxy]pyridin-4-yl]-6-methylpyridin-3-yl]-2-(2-fluoropropan-2-yl)pyridine-4-carboxamide
CID 135139020
2-(1-cyanocyclopropyl)-N-[3-[5-(3-hydroxyoxetan-3-yl)-6-methoxy-3-pyridinyl]-4-methylphenyl]pyridine-4-carboxamide;2-(1,1-difluoroethyl)-N-[3-[5-[3-(fluoromethyl)oxetan-3-yl]-6-methoxy-3-pyridinyl]-4-methylphenyl]pyridine-4-carboxamide;2-(difluoromethyl)-N-[3-[5-(3-hydroxyoxetan-3-yl)-6-methoxy-3-pyridinyl]-4-methylphenyl]pyridine-4-carboxamide;N-[3-[5-[3-(fluoromethyl)oxetan-3-yl]-6-methoxy-3-pyridinyl]-4-methylphenyl]-2-(2-fluoropropan-2-yl)pyridine-4-carboxamide;N-[5-[5-(3-fluorooxetan-3-yl)-6-methoxy-3-pyridinyl]-6-methyl-3-pyridinyl]-2-(2-fluoropropan-2-yl)pyridine-4-carboxamide;N-[5-[5-(3-fluorooxetan-3-yl)-6-methoxy-3-pyridinyl]-6-methyl-3-pyridinyl]-2-(2-hydroxypropan-2-yl)pyridine-4-carboxamide;2-(2-fluoropropan-2-yl)-N-[3-[5-(3-hydroxyoxetan-3-yl)-6-methoxy-3-pyridinyl]-4-methylphenyl]pyridine-4-carboxamide
CID 157328206
N-[5-[6-ethoxy-5-(3-fluorooxolan-3-yl)-3-pyridinyl]-6-methyl-3-pyridinyl]-3-(trifluoromethyl)benzamide;N-[3-[6-ethoxy-5-(3-hydroxyoxolan-3-yl)-3-pyridinyl]-4-methylphenyl]-2-(2-methylbut-3-yn-2-yl)pyridine-4-carboxamide
CID 157400767
CID 157550020
CID 157550020
2-(1,1-difluoroethyl)-N-[3-[2-[3-(fluoromethyl)oxetan-3-yl]-6-(2-hydroxyethoxy)-4-pyridinyl]-4-methylphenyl]pyridine-4-carboxamide;2-(difluoromethyl)-N-[3-[2-[3-(fluoromethyl)oxetan-3-yl]-6-(2-hydroxyethoxy)-4-pyridinyl]-4-methylphenyl]pyridine-4-carboxamide;N-[3-[2-[3-(difluoromethyl)oxetan-3-yl]-6-(2-hydroxyethoxy)-4-pyridinyl]-4-methylphenyl]-2-(trifluoromethyl)pyridine-4-carboxamide;N-[3-[2-[3-(fluoromethyl)oxetan-3-yl]-6-(2-hydroxyethoxy)-4-pyridinyl]-4-methylphenyl]-2-(trifluoromethyl)pyridine-4-carboxamide;N-[3-[6-(2-hydroxyethoxy)-5-(3-methoxyoxetan-3-yl)-3-pyridinyl]-4-methylphenyl]-2-(trifluoromethyl)pyridine-4-carboxamide
CID 157697728
2-(2-cyanopropan-2-yl)-N-[3-[5-(3-formyloxetan-3-yl)-6-methoxy-3-pyridinyl]-4-methylphenyl]pyridine-4-carboxamide;2-(1,1-difluoroethyl)-N-[5-[5-(3-fluorooxetan-3-yl)-6-(2-hydroxyethoxy)-3-pyridinyl]-6-methyl-3-pyridinyl]pyridine-4-carboxamide;N-[5-[5-[3-(difluoromethyl)oxetan-3-yl]-6-methoxy-3-pyridinyl]-6-methyl-3-pyridinyl]-2-(2-fluoropropan-2-yl)pyridine-4-carboxamide;N-[3-[5-(3-fluorooxetan-3-yl)-6-(2-hydroxyethoxy)-3-pyridinyl]-4-methylphenyl]-2-(2-fluoropropan-2-yl)pyridine-4-carboxamide;N-[5-[5-(3-fluorooxetan-3-yl)-6-(2-hydroxyethoxy)-3-pyridinyl]-6-methyl-3-pyridinyl]-2-(2-fluoropropan-2-yl)pyridine-4-carboxamide;N-[5-[4-(3-fluorooxetan-3-yl)-5-(3-hydroxypropoxy)-2-pyridinyl]-6-methyl-3-pyridinyl]-2-(2-fluoropropan-2-yl)pyridine-4-carboxamide
CID 157700858
2-(2-cyanopropan-2-yl)-N-[3-[6-ethoxy-5-[3-(fluoromethyl)oxetan-3-yl]-3-pyridinyl]-4-methylphenyl]pyridine-4-carboxamide;2-(2-cyanopropan-2-yl)-N-[3-[5-(3-fluorooxetan-3-yl)-6-methoxy-3-pyridinyl]-4-methylphenyl]pyridine-4-carboxamide;2-(2-cyanopropan-2-yl)-N-[3-[5-(3-hydroxyoxetan-3-yl)-6-(oxan-4-yloxy)-3-pyridinyl]-4-methylphenyl]pyridine-4-carboxamide;2-(2-cyanopropan-2-yl)-N-[5-[5-(3-hydroxyoxetan-3-yl)-6-(oxan-4-yloxy)-3-pyridinyl]-6-methyl-3-pyridinyl]pyridine-4-carboxamide;N-[5-[5-(3-fluorooxetan-3-yl)-6-(2-hydroxyethoxy)-3-pyridinyl]-6-methyl-3-pyridinyl]-2-(trifluoromethyl)pyridine-4-carboxamide;N-[3-[5-(3-hydroxyoxetan-3-yl)-6-(oxan-4-yloxy)-3-pyridinyl]-4-methylphenyl]-2-(trifluoromethyl)pyridine-4-carboxamide
CID 157705195
3-(2-aminopropan-2-yl)-N-[5-[5-(3-cyanooxetan-3-yl)-6-methoxy-3-pyridinyl]-6-methyl-3-pyridinyl]-5-(trifluoromethyl)benzamide;3-(2-aminopropan-2-yl)-N-[3-[5-[3-(difluoromethyl)oxetan-3-yl]-6-methoxy-3-pyridinyl]-4-methylphenyl]-5-(trifluoromethyl)benzamide;3-(2-aminopropan-2-yl)-N-[5-[5-[3-(difluoromethyl)oxetan-3-yl]-6-methoxy-3-pyridinyl]-6-methyl-3-pyridinyl]-5-(trifluoromethyl)benzamide;N-[3-[5-(3-hydroxyoxetan-3-yl)-6-(oxan-4-yloxy)-3-pyridinyl]-4-methylphenyl]-3-(trifluoromethyl)benzamide;N-[5-[5-(3-hydroxyoxetan-3-yl)-6-(oxan-4-yloxy)-3-pyridinyl]-6-methyl-3-pyridinyl]-3-(trifluoromethyl)benzamide
CID 157754099
2-(difluoromethyl)-N-[3-[6-ethoxy-5-(3-hydroxyoxetan-3-yl)-3-pyridinyl]-4-methylphenyl]pyridine-4-carboxamide;N-[5-[6-ethoxy-5-[3-(fluoromethyl)oxetan-3-yl]-3-pyridinyl]-6-methyl-3-pyridinyl]-2-(2-fluoropropan-2-yl)pyridine-4-carboxamide;N-[3-[6-ethoxy-5-(3-hydroxyoxetan-3-yl)-3-pyridinyl]-4-methylphenyl]-2-(trifluoromethyl)pyridine-4-carboxamide;N-[5-[2-[3-(fluoromethyl)oxetan-3-yl]-6-(2-hydroxyethoxy)-4-pyridinyl]-6-methyl-3-pyridinyl]-2-(2-fluoropropan-2-yl)pyridine-4-carboxamide;N-[3-[3-(3-fluorooxetan-3-yl)-5-(3-hydroxyoxetan-3-yl)phenyl]-4-methylphenyl]-2-(trifluoromethyl)pyridine-4-carboxamide;N-[5-[3-(3-fluorooxetan-3-yl)-5-(3-hydroxyoxetan-3-yl)phenyl]-6-methyl-3-pyridinyl]-2-(trifluoromethyl)pyridine-4-carboxamide
CID 157818973
2-(1,1-difluoroethyl)-N-[3-[6-ethoxy-5-(3-hydroxyoxetan-3-yl)-3-pyridinyl]-4-methylphenyl]pyridine-4-carboxamide;2-(difluoromethyl)-N-[3-[6-ethoxy-5-(3-hydroxyoxetan-3-yl)-3-pyridinyl]-4-methylphenyl]pyridine-4-carboxamide;N-[5-[6-ethoxy-5-[3-(fluoromethyl)oxetan-3-yl]-3-pyridinyl]-6-methyl-3-pyridinyl]-2-(2-fluoropropan-2-yl)pyridine-4-carboxamide;N-[3-[6-ethoxy-5-(3-hydroxyoxetan-3-yl)-3-pyridinyl]-4-methylphenyl]-2-(trifluoromethyl)pyridine-4-carboxamide;N-[5-[2-[3-(fluoromethyl)oxetan-3-yl]-6-(2-hydroxyethoxy)-4-pyridinyl]-6-methyl-3-pyridinyl]-2-(2-fluoropropan-2-yl)pyridine-4-carboxamide;N-[3-[3-(3-fluorooxetan-3-yl)-5-(3-hydroxyoxetan-3-yl)phenyl]-4-methylphenyl]-2-(trifluoromethyl)pyridine-4-carboxamide
CID 157883507
2-(2-cyanopropan-2-yl)-N-[3-[2-[4-(fluoromethyl)oxan-4-yl]-6-(2-hydroxyethoxy)-4-pyridinyl]-4-methylphenyl]pyridine-4-carboxamide;2-(1,1-difluoroethyl)-N-[3-[2-[4-(fluoromethyl)oxan-4-yl]-6-(2-hydroxyethoxy)-4-pyridinyl]-4-methylphenyl]pyridine-4-carboxamide;N-[3-[2-[4-(fluoromethyl)oxan-4-yl]-6-(2-hydroxyethoxy)-4-pyridinyl]-4-methylphenyl]-6-(trifluoromethyl)pyridazine-4-carboxamide;N-[3-[2-[4-(fluoromethyl)oxan-4-yl]-6-(2-hydroxyethoxy)-4-pyridinyl]-4-methylphenyl]-2-(trifluoromethyl)pyridine-4-carboxamide;N-[3-[2-[4-(fluoromethyl)oxan-4-yl]-6-(2-hydroxyethoxy)-4-pyridinyl]-4-methylphenyl]-4-(trifluoromethyl)pyridine-2-carboxamide
CID 158041973
2-(2-cyanopropan-2-yl)-N-[3-[6-(2-hydroxyethoxy)-5-morpholin-4-ylpyridazin-3-yl]-4-methylphenyl]pyridine-4-carboxamide;2-(1,1-difluoroethyl)-N-[4-methyl-3-(5-morpholin-4-yl-6-propan-2-yloxypyridazin-3-yl)phenyl]pyridine-4-carboxamide;2-(difluoromethyl)-N-[4-methyl-3-(5-morpholin-4-yl-6-propan-2-yloxypyridazin-3-yl)phenyl]pyridine-4-carboxamide;2-(2-fluoropropan-2-yl)-N-[4-methyl-3-(5-morpholin-4-yl-6-propan-2-yloxypyridazin-3-yl)phenyl]pyridine-4-carboxamide;N-[3-[6-(2-hydroxyethoxy)-5-morpholin-4-ylpyridazin-3-yl]-4-methylphenyl]-3-(trifluoromethyl)benzamide;N-[4-methyl-3-(5-morpholin-4-yl-6-propan-2-yloxypyridazin-3-yl)phenyl]-4-(trifluoromethyl)pyridine-2-carboxamide
CID 158076394

Frequently Asked Questions

What is the IUPAC name of 2-[3-(difluoromethyl)phenyl]-1-[3-[5-(3-hydroxyoxetan-3-yl)-6-methoxy-3-pyridinyl]-4-methylphenyl]ethanone;N-[5-[6-(2-hydroxyethoxy)-5-(3-methyloxetan-3-yl)pyridazin-3-yl]-6-methyl-3-pyridinyl]-3-(trifluoromethyl)benzamide;N-[3-[3-methoxy-5-(oxetan-3-yl)phenyl]-4-methylphenyl]-3-(trifluoromethyl)benzamide;N-[5-[3-methoxy-5-(oxetan-3-yl)phenyl]-6-methyl-3-pyridinyl]-3-(trifluoromethyl)benzamide;N-[6-methyl-5-[3-(3-methyloxetan-3-yl)phenyl]-3-pyridinyl]-3-(trifluoromethyl)benzamide;N-[6-methyl-5-[3-(oxetan-3-yl)phenyl]-3-pyridinyl]-3-(trifluoromethyl)benzamide?
The IUPAC name of 2-[3-(difluoromethyl)phenyl]-1-[3-[5-(3-hydroxyoxetan-3-yl)-6-methoxy-3-pyridinyl]-4-methylphenyl]ethanone;N-[5-[6-(2-hydroxyethoxy)-5-(3-methyloxetan-3-yl)pyridazin-3-yl]-6-methyl-3-pyridinyl]-3-(trifluoromethyl)benzamide;N-[3-[3-methoxy-5-(oxetan-3-yl)phenyl]-4-methylphenyl]-3-(trifluoromethyl)benzamide;N-[5-[3-methoxy-5-(oxetan-3-yl)phenyl]-6-methyl-3-pyridinyl]-3-(trifluoromethyl)benzamide;N-[6-methyl-5-[3-(3-methyloxetan-3-yl)phenyl]-3-pyridinyl]-3-(trifluoromethyl)benzamide;N-[6-methyl-5-[3-(oxetan-3-yl)phenyl]-3-pyridinyl]-3-(trifluoromethyl)benzamide (CID 158499476) is 2-[3-(difluoromethyl)phenyl]-1-[3-[5-(3-hydroxyoxetan-3-yl)-6-methoxy-3-pyridinyl]-4-methylphenyl]ethanone;N-[5-[6-(2-hydroxyethoxy)-5-(3-methyloxetan-3-yl)pyridazin-3-yl]-6-methyl-3-pyridinyl]-3-(trifluoromethyl)benzamide;N-[3-[3-methoxy-5-(oxetan-3-yl)phenyl]-4-methylphenyl]-3-(trifluoromethyl)benzamide;N-[5-[3-methoxy-5-(oxetan-3-yl)phenyl]-6-methyl-3-pyridinyl]-3-(trifluoromethyl)benzamide;N-[6-methyl-5-[3-(3-methyloxetan-3-yl)phenyl]-3-pyridinyl]-3-(trifluoromethyl)benzamide;N-[6-methyl-5-[3-(oxetan-3-yl)phenyl]-3-pyridinyl]-3-(trifluoromethyl)benzamide.
What is the SMILES notation for 2-[3-(difluoromethyl)phenyl]-1-[3-[5-(3-hydroxyoxetan-3-yl)-6-methoxy-3-pyridinyl]-4-methylphenyl]ethanone;N-[5-[6-(2-hydroxyethoxy)-5-(3-methyloxetan-3-yl)pyridazin-3-yl]-6-methyl-3-pyridinyl]-3-(trifluoromethyl)benzamide;N-[3-[3-methoxy-5-(oxetan-3-yl)phenyl]-4-methylphenyl]-3-(trifluoromethyl)benzamide;N-[5-[3-methoxy-5-(oxetan-3-yl)phenyl]-6-methyl-3-pyridinyl]-3-(trifluoromethyl)benzamide;N-[6-methyl-5-[3-(3-methyloxetan-3-yl)phenyl]-3-pyridinyl]-3-(trifluoromethyl)benzamide;N-[6-methyl-5-[3-(oxetan-3-yl)phenyl]-3-pyridinyl]-3-(trifluoromethyl)benzamide?
The canonical SMILES for 2-[3-(difluoromethyl)phenyl]-1-[3-[5-(3-hydroxyoxetan-3-yl)-6-methoxy-3-pyridinyl]-4-methylphenyl]ethanone;N-[5-[6-(2-hydroxyethoxy)-5-(3-methyloxetan-3-yl)pyridazin-3-yl]-6-methyl-3-pyridinyl]-3-(trifluoromethyl)benzamide;N-[3-[3-methoxy-5-(oxetan-3-yl)phenyl]-4-methylphenyl]-3-(trifluoromethyl)benzamide;N-[5-[3-methoxy-5-(oxetan-3-yl)phenyl]-6-methyl-3-pyridinyl]-3-(trifluoromethyl)benzamide;N-[6-methyl-5-[3-(3-methyloxetan-3-yl)phenyl]-3-pyridinyl]-3-(trifluoromethyl)benzamide;N-[6-methyl-5-[3-(oxetan-3-yl)phenyl]-3-pyridinyl]-3-(trifluoromethyl)benzamide is COc1cc(-c2cc(NC(=O)c3cccc(C(F)(F)F)c3)ccc2C)cc(C2COC2)c1.COc1cc(-c2cc(NC(=O)c3cccc(C(F)(F)F)c3)cnc2C)cc(C2COC2)c1.COc1ncc(-c2cc(C(=O)Cc3cccc(C(F)F)c3)ccc2C)cc1C1(O)COC1.Cc1ncc(NC(=O)c2cccc(C(F)(F)F)c2)cc1-c1cc(C2(C)COC2)c(OCCO)nn1.Cc1ncc(NC(=O)c2cccc(C(F)(F)F)c2)cc1-c1cccc(C2(C)COC2)c1.Cc1ncc(NC(=O)c2cccc(C(F)(F)F)c2)cc1-c1cccc(C2COC2)c1.
What is the InChIKey of 2-[3-(difluoromethyl)phenyl]-1-[3-[5-(3-hydroxyoxetan-3-yl)-6-methoxy-3-pyridinyl]-4-methylphenyl]ethanone;N-[5-[6-(2-hydroxyethoxy)-5-(3-methyloxetan-3-yl)pyridazin-3-yl]-6-methyl-3-pyridinyl]-3-(trifluoromethyl)benzamide;N-[3-[3-methoxy-5-(oxetan-3-yl)phenyl]-4-methylphenyl]-3-(trifluoromethyl)benzamide;N-[5-[3-methoxy-5-(oxetan-3-yl)phenyl]-6-methyl-3-pyridinyl]-3-(trifluoromethyl)benzamide;N-[6-methyl-5-[3-(3-methyloxetan-3-yl)phenyl]-3-pyridinyl]-3-(trifluoromethyl)benzamide;N-[6-methyl-5-[3-(oxetan-3-yl)phenyl]-3-pyridinyl]-3-(trifluoromethyl)benzamide?
The InChIKey is HJSCEYAOBBUFRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H22F3NO3.C25H23F2NO4.C24H23F3N4O4.C24H21F3N2O3.C24H21F3N2O2.C23H19F3N2O2/c1-15-6-7-21(29-24(30)16-4-3-5-20(9-16)25(26,27)28)12-23(15)18-8-17(19-13-32-14-19)10-22(11-18)31-2;1-15-6-7-17(22(29)9-16-4-3-5-18(8-16)23(26)27)10-20(15)19-11-21(24(31-2)28-12-19)25(30)13-32-14-25;1-14-18(20-10-19(23(2)12-34-13-23)22(31-30-20)35-7-6-32)9-17(11-28-14)29-21(33)15-4-3-5-16(8-15)24(25,26)27;1-14-22(17-6-16(18-12-32-13-18)8-21(9-17)31-2)10-20(11-28-14)29-23(30)15-4-3-5-19(7-15)24(25,26)27;1-15-21(16-5-3-7-18(9-16)23(2)13-31-14-23)11-20(12-28-15)29-22(30)17-6-4-8-19(10-17)24(25,26)27;1-14-21(16-5-2-4-15(8-16)18-12-30-13-18)10-20(11-27-14)28-22(29)17-6-3-7-19(9-17)23(24,25)26/h3-12,19H,13-14H2,1-2H3,(H,29,30);3-8,10-12,23,30H,9,13-14H2,1-2H3;3-5,8-11,32H,6-7,12-13H2,1-2H3,(H,29,33);3-11,18H,12-13H2,1-2H3,(H,29,30);3-12H,13-14H2,1-2H3,(H,29,30);2-11,18H,12-13H2,1H3,(H,28,29).
What are the key properties of 2-[3-(difluoromethyl)phenyl]-1-[3-[5-(3-hydroxyoxetan-3-yl)-6-methoxy-3-pyridinyl]-4-methylphenyl]ethanone;N-[5-[6-(2-hydroxyethoxy)-5-(3-methyloxetan-3-yl)pyridazin-3-yl]-6-methyl-3-pyridinyl]-3-(trifluoromethyl)benzamide;N-[3-[3-methoxy-5-(oxetan-3-yl)phenyl]-4-methylphenyl]-3-(trifluoromethyl)benzamide;N-[5-[3-methoxy-5-(oxetan-3-yl)phenyl]-6-methyl-3-pyridinyl]-3-(trifluoromethyl)benzamide;N-[6-methyl-5-[3-(3-methyloxetan-3-yl)phenyl]-3-pyridinyl]-3-(trifluoromethyl)benzamide;N-[6-methyl-5-[3-(oxetan-3-yl)phenyl]-3-pyridinyl]-3-(trifluoromethyl)benzamide?
2-[3-(difluoromethyl)phenyl]-1-[3-[5-(3-hydroxyoxetan-3-yl)-6-methoxy-3-pyridinyl]-4-methylphenyl]ethanone;N-[5-[6-(2-hydroxyethoxy)-5-(3-methyloxetan-3-yl)pyridazin-3-yl]-6-methyl-3-pyridinyl]-3-(trifluoromethyl)benzamide;N-[3-[3-methoxy-5-(oxetan-3-yl)phenyl]-4-methylphenyl]-3-(trifluoromethyl)benzamide;N-[5-[3-methoxy-5-(oxetan-3-yl)phenyl]-6-methyl-3-pyridinyl]-3-(trifluoromethyl)benzamide;N-[6-methyl-5-[3-(3-methyloxetan-3-yl)phenyl]-3-pyridinyl]-3-(trifluoromethyl)benzamide;N-[6-methyl-5-[3-(oxetan-3-yl)phenyl]-3-pyridinyl]-3-(trifluoromethyl)benzamide has a molecular weight of 2650.66 g/mol, XLogP of 30.99, 32 rotatable bonds, 7 hydrogen bond donors, and 25 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(difluoromethyl)phenyl]-1-[3-[5-(3-hydroxyoxetan-3-yl)-6-methoxy-3-pyridinyl]-4-methylphenyl]ethanone;N-[5-[6-(2-hydroxyethoxy)-5-(3-methyloxetan-3-yl)pyridazin-3-yl]-6-methyl-3-pyridinyl]-3-(trifluoromethyl)benzamide;N-[3-[3-methoxy-5-(oxetan-3-yl)phenyl]-4-methylphenyl]-3-(trifluoromethyl)benzamide;N-[5-[3-methoxy-5-(oxetan-3-yl)phenyl]-6-methyl-3-pyridinyl]-3-(trifluoromethyl)benzamide;N-[6-methyl-5-[3-(3-methyloxetan-3-yl)phenyl]-3-pyridinyl]-3-(trifluoromethyl)benzamide;N-[6-methyl-5-[3-(oxetan-3-yl)phenyl]-3-pyridinyl]-3-(trifluoromethyl)benzamide is sourced from PubChem (CID 158499476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).