5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-[4-(4-methylimidazol-1-yl)phenyl]-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide;5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-[4-(3-methylpyrazol-1-yl)phenyl]-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide;5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-[4-(4-methylpyrazol-1-yl)phenyl]-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide;5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-(4-pyrazol-1-ylphenyl)-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide;5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-(4-pyrrol-1-ylphenyl)-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide

C164H157F15N24O15 — CID 158318002

IUPAC5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-[4-(4-methylimidazol-1-yl)phenyl]-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide;5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-[4-(3-methylpyrazol-1-yl)phenyl]-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide;5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-[4-(4-methylpyrazol-1-yl)phenyl]-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide;5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-(4-pyrazol-1-ylphenyl)-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide;5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-(4-pyrrol-1-ylphenyl)-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide
SMILESCNC(=O)c1c(-c2ccc(-n3cc(C)cn3)cc2)oc2nc(CCC(F)(F)F)c(-c3cccc(C(=O)NC(C)(C)C)c3)cc12.CNC(=O)c1c(-c2ccc(-n3ccc(C)n3)cc2)oc2nc(CCC(F)(F)F)c(-c3cccc(C(=O)NC(C)(C)C)c3)cc12.CNC(=O)c1c(-c2ccc(-n3cccc3)cc2)oc2nc(CCC(F)(F)F)c(-c3cccc(C(=O)NC(C)(C)C)c3)cc12.CNC(=O)c1c(-c2ccc(-n3cccn3)cc2)oc2nc(CCC(F)(F)F)c(-c3cccc(C(=O)NC(C)(C)C)c3)cc12.CNC(=O)c1c(-c2ccc(-n3cnc(C)c3)cc2)oc2nc(CCC(F)(F)F)c(-c3cccc(C(=O)NC(C)(C)C)c3)cc12
InChIInChI=1S/3C33H32F3N5O3.C33H31F3N4O3.C32H30F3N5O3/c1-19-14-16-41(40-19)23-11-9-20(10-12-23)28-27(30(43)37-5)25-18-24(26(38-31(25)44-28)13-15-33(34,35)36)21-7-6-8-22(17-21)29(42)39-32(2,3)4;1-19-17-41(18-38-19)23-11-9-20(10-12-23)28-27(30(43)37-5)25-16-24(26(39-31(25)44-28)13-14-33(34,35)36)21-7-6-8-22(15-21)29(42)40-32(2,3)4;1-19-17-38-41(18-19)23-11-9-20(10-12-23)28-27(30(43)37-5)25-16-24(26(39-31(25)44-28)13-14-33(34,35)36)21-7-6-8-22(15-21)29(42)40-32(2,3)4;1-32(2,3)39-29(41)22-9-7-8-21(18-22)24-19-25-27(30(42)37-4)28(43-31(25)38-26(24)14-15-33(34,35)36)20-10-12-23(13-11-20)40-16-5-6-17-40;1-31(2,3)39-28(41)21-8-5-7-20(17-21)23-18-24-26(29(42)36-4)27(43-30(24)38-25(23)13-14-32(33,34)35)19-9-11-22(12-10-19)40-16-6-15-37-40/h6-12,14,16-18H,13,15H2,1-5H3,(H,37,43)(H,39,42);2*6-12,15-18H,13-14H2,1-5H3,(H,37,43)(H,40,42);5-13,16-19H,14-15H2,1-4H3,(H,37,42)(H,39,41);5-12,15-18H,13-14H2,1-4H3,(H,36,42)(H,39,41)
InChIKeyGOMUGWJHTIVSOM-UHFFFAOYSA-N
MW2989.18 g/mol
LogP35.18
Rot. Bonds35

About 5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-[4-(4-methylimidazol-1-yl)phenyl]-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide;5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-[4-(3-methylpyrazol-1-yl)phenyl]-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide;5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-[4-(4-methylpyrazol-1-yl)phenyl]-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide;5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-(4-pyrazol-1-ylphenyl)-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide;5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-(4-pyrrol-1-ylphenyl)-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide

5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-[4-(4-methylimidazol-1-yl)phenyl]-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide;5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-[4-(3-methylpyrazol-1-yl)phenyl]-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide;5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-[4-(4-methylpyrazol-1-yl)phenyl]-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide;5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-(4-pyrazol-1-ylphenyl)-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide;5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-(4-pyrrol-1-ylphenyl)-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide (PubChem CID 158318002) has the molecular formula C164H157F15N24O15 and a molecular weight of 2989.18 g/mol. Its IUPAC name is 5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-[4-(4-methylimidazol-1-yl)phenyl]-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide;5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-[4-(3-methylpyrazol-1-yl)phenyl]-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide;5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-[4-(4-methylpyrazol-1-yl)phenyl]-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide;5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-(4-pyrazol-1-ylphenyl)-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide;5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-(4-pyrrol-1-ylphenyl)-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide.

Molecular Properties

Compound Name5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-[4-(4-methylimidazol-1-yl)phenyl]-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide;5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-[4-(3-methylpyrazol-1-yl)phenyl]-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide;5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-[4-(4-methylpyrazol-1-yl)phenyl]-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide;5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-(4-pyrazol-1-ylphenyl)-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide;5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-(4-pyrrol-1-ylphenyl)-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide
PubChem CID158318002
Molecular FormulaC164H157F15N24O15
Molecular Weight2989.18 g/mol
Exact Mass2987.20
IUPAC Name5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-[4-(4-methylimidazol-1-yl)phenyl]-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide;5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-[4-(3-methylpyrazol-1-yl)phenyl]-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide;5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-[4-(4-methylpyrazol-1-yl)phenyl]-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide;5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-(4-pyrazol-1-ylphenyl)-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide;5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-(4-pyrrol-1-ylphenyl)-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide
SMILESCNC(=O)c1c(-c2ccc(-n3cc(C)cn3)cc2)oc2nc(CCC(F)(F)F)c(-c3cccc(C(=O)NC(C)(C)C)c3)cc12.CNC(=O)c1c(-c2ccc(-n3ccc(C)n3)cc2)oc2nc(CCC(F)(F)F)c(-c3cccc(C(=O)NC(C)(C)C)c3)cc12.CNC(=O)c1c(-c2ccc(-n3cccc3)cc2)oc2nc(CCC(F)(F)F)c(-c3cccc(C(=O)NC(C)(C)C)c3)cc12.CNC(=O)c1c(-c2ccc(-n3cccn3)cc2)oc2nc(CCC(F)(F)F)c(-c3cccc(C(=O)NC(C)(C)C)c3)cc12.CNC(=O)c1c(-c2ccc(-n3cnc(C)c3)cc2)oc2nc(CCC(F)(F)F)c(-c3cccc(C(=O)NC(C)(C)C)c3)cc12
InChIInChI=1S/3C33H32F3N5O3.C33H31F3N4O3.C32H30F3N5O3/c1-19-14-16-41(40-19)23-11-9-20(10-12-23)28-27(30(43)37-5)25-18-24(26(38-31(25)44-28)13-15-33(34,35)36)21-7-6-8-22(17-21)29(42)39-32(2,3)4;1-19-17-41(18-38-19)23-11-9-20(10-12-23)28-27(30(43)37-5)25-16-24(26(39-31(25)44-28)13-14-33(34,35)36)21-7-6-8-22(15-21)29(42)40-32(2,3)4;1-19-17-38-41(18-19)23-11-9-20(10-12-23)28-27(30(43)37-5)25-16-24(26(39-31(25)44-28)13-14-33(34,35)36)21-7-6-8-22(15-21)29(42)40-32(2,3)4;1-32(2,3)39-29(41)22-9-7-8-21(18-22)24-19-25-27(30(42)37-4)28(43-31(25)38-26(24)14-15-33(34,35)36)20-10-12-23(13-11-20)40-16-5-6-17-40;1-31(2,3)39-28(41)21-8-5-7-20(17-21)23-18-24-26(29(42)36-4)27(43-30(24)38-25(23)13-14-32(33,34)35)19-9-11-22(12-10-19)40-16-6-15-37-40/h6-12,14,16-18H,13,15H2,1-5H3,(H,37,43)(H,39,42);2*6-12,15-18H,13-14H2,1-5H3,(H,37,43)(H,40,42);5-13,16-19H,14-15H2,1-4H3,(H,37,42)(H,39,41);5-12,15-18H,13-14H2,1-4H3,(H,36,42)(H,39,41)
InChIKeyGOMUGWJHTIVSOM-UHFFFAOYSA-N
XLogP35.18
TPSA497.36 Ų
H-Bond Donors10
H-Bond Acceptors29
Rotatable Bonds35
Heavy Atoms218
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002989.18
LogP ≤ 535.18
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1029

Analyze 5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-[4-(4-methylimidazol-1-yl)phenyl]-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide;5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-[4-(3-methylpyrazol-1-yl)phenyl]-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide;5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-[4-(4-methylpyrazol-1-yl)phenyl]-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide;5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-(4-pyrazol-1-ylphenyl)-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide;5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-(4-pyrrol-1-ylphenyl)-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide with MolForge

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Related Compounds

5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-6-[4-(trifluoromethyl)pyrazol-1-yl]-2-[4-[4-(trifluoromethyl)pyrazol-1-yl]phenyl]furo[2,3-b]pyridine-3-carboxamide
CID 118533400
5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-6-[3-(trifluoromethyl)pyrazol-1-yl]-2-[4-[3-(trifluoromethyl)pyrazol-1-yl]phenyl]furo[2,3-b]pyridine-3-carboxamide
CID 118533403
5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-[4-(4-methylimidazol-1-yl)phenyl]-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide
CID 118533404
5-[3-(tert-butylcarbamoyl)phenyl]-2-(4-imidazol-1-ylphenyl)-N-methyl-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide
CID 118533411
5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-[4-(5-methylimidazol-1-yl)phenyl]-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide
CID 129013316
5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-6-[4-(trifluoromethyl)pyrazol-1-yl]-2-[4-[4-(trifluoromethyl)triazol-2-yl]phenyl]furo[2,3-b]pyridine-3-carboxamide
CID 129031590
5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-6-[3-(trifluoromethyl)pyrazol-1-yl]-2-[4-[4-(trifluoromethyl)pyrazol-1-yl]phenyl]furo[2,3-b]pyridine-3-carboxamide
CID 129033235
5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-[4-(4-methylpyrazol-1-yl)phenyl]-6-[3-(trifluoromethyl)pyrazol-1-yl]furo[2,3-b]pyridine-3-carboxamide
CID 129033236
5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-[4-(4-methylimidazol-1-yl)phenyl]-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide;5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-[4-(3-methylpyrazol-1-yl)phenyl]-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide
CID 144964468
5-[3-(tert-butylcarbamoyl)phenyl]-2-[4-[[(Z)-3-iminobut-1-enyl]amino]phenyl]-N-methyl-6-[3-(trifluoromethyl)pyrazol-1-yl]furo[2,3-b]pyridine-3-carboxamide
CID 144964470
N-[3-[[2-(furan-3-yl)-9-methylpurin-6-yl]amino]-4-methylphenyl]-3-(trifluoromethoxy)benzamide;N-[4-methyl-3-[(9-methyl-2-pyridin-4-ylpurin-6-yl)amino]phenyl]-3-(trifluoromethoxy)benzamide;4-methyl-3-[[2-(1H-pyrazol-4-yl)-5H-pyrrolo[3,2-d]pyrimidin-4-yl]amino]-N-[3-(trifluoromethyl)phenyl]benzamide;2-[4-methyl-3-[(2-pyridin-3-yl-5H-pyrrolo[3,2-d]pyrimidin-4-yl)amino]phenyl]-1-[3-(trifluoromethyl)phenyl]ethanone;3-[(2-pyridin-3-yl-5H-pyrrolo[3,2-d]pyrimidin-4-yl)amino]-N-[3-(trifluoromethyl)phenyl]benzamide
CID 157248494
5-[1-(4-cyanophenyl)pyrrolo[3,2-b]pyridin-6-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[1-(3,5-difluorophenyl)imidazo[4,5-c]pyridin-6-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[1-(4-fluorophenyl)imidazo[4,5-c]pyridin-6-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[1-(4-fluorophenyl)pyrrolo[3,2-b]pyridin-6-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-[1-[4-(trifluoromethyl)phenyl]pyrrolo[3,2-b]pyridin-6-yl]-1-benzofuran-3-carboxamide
CID 157376914

Frequently Asked Questions

What is the IUPAC name of 5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-[4-(4-methylimidazol-1-yl)phenyl]-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide;5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-[4-(3-methylpyrazol-1-yl)phenyl]-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide;5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-[4-(4-methylpyrazol-1-yl)phenyl]-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide;5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-(4-pyrazol-1-ylphenyl)-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide;5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-(4-pyrrol-1-ylphenyl)-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide?
The IUPAC name of 5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-[4-(4-methylimidazol-1-yl)phenyl]-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide;5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-[4-(3-methylpyrazol-1-yl)phenyl]-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide;5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-[4-(4-methylpyrazol-1-yl)phenyl]-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide;5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-(4-pyrazol-1-ylphenyl)-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide;5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-(4-pyrrol-1-ylphenyl)-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide (CID 158318002) is 5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-[4-(4-methylimidazol-1-yl)phenyl]-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide;5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-[4-(3-methylpyrazol-1-yl)phenyl]-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide;5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-[4-(4-methylpyrazol-1-yl)phenyl]-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide;5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-(4-pyrazol-1-ylphenyl)-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide;5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-(4-pyrrol-1-ylphenyl)-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide.
What is the SMILES notation for 5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-[4-(4-methylimidazol-1-yl)phenyl]-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide;5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-[4-(3-methylpyrazol-1-yl)phenyl]-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide;5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-[4-(4-methylpyrazol-1-yl)phenyl]-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide;5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-(4-pyrazol-1-ylphenyl)-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide;5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-(4-pyrrol-1-ylphenyl)-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide?
The canonical SMILES for 5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-[4-(4-methylimidazol-1-yl)phenyl]-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide;5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-[4-(3-methylpyrazol-1-yl)phenyl]-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide;5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-[4-(4-methylpyrazol-1-yl)phenyl]-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide;5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-(4-pyrazol-1-ylphenyl)-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide;5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-(4-pyrrol-1-ylphenyl)-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide is CNC(=O)c1c(-c2ccc(-n3cc(C)cn3)cc2)oc2nc(CCC(F)(F)F)c(-c3cccc(C(=O)NC(C)(C)C)c3)cc12.CNC(=O)c1c(-c2ccc(-n3ccc(C)n3)cc2)oc2nc(CCC(F)(F)F)c(-c3cccc(C(=O)NC(C)(C)C)c3)cc12.CNC(=O)c1c(-c2ccc(-n3cccc3)cc2)oc2nc(CCC(F)(F)F)c(-c3cccc(C(=O)NC(C)(C)C)c3)cc12.CNC(=O)c1c(-c2ccc(-n3cccn3)cc2)oc2nc(CCC(F)(F)F)c(-c3cccc(C(=O)NC(C)(C)C)c3)cc12.CNC(=O)c1c(-c2ccc(-n3cnc(C)c3)cc2)oc2nc(CCC(F)(F)F)c(-c3cccc(C(=O)NC(C)(C)C)c3)cc12.
What is the InChIKey of 5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-[4-(4-methylimidazol-1-yl)phenyl]-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide;5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-[4-(3-methylpyrazol-1-yl)phenyl]-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide;5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-[4-(4-methylpyrazol-1-yl)phenyl]-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide;5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-(4-pyrazol-1-ylphenyl)-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide;5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-(4-pyrrol-1-ylphenyl)-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide?
The InChIKey is GOMUGWJHTIVSOM-UHFFFAOYSA-N. The full InChI is InChI=1S/3C33H32F3N5O3.C33H31F3N4O3.C32H30F3N5O3/c1-19-14-16-41(40-19)23-11-9-20(10-12-23)28-27(30(43)37-5)25-18-24(26(38-31(25)44-28)13-15-33(34,35)36)21-7-6-8-22(17-21)29(42)39-32(2,3)4;1-19-17-41(18-38-19)23-11-9-20(10-12-23)28-27(30(43)37-5)25-16-24(26(39-31(25)44-28)13-14-33(34,35)36)21-7-6-8-22(15-21)29(42)40-32(2,3)4;1-19-17-38-41(18-19)23-11-9-20(10-12-23)28-27(30(43)37-5)25-16-24(26(39-31(25)44-28)13-14-33(34,35)36)21-7-6-8-22(15-21)29(42)40-32(2,3)4;1-32(2,3)39-29(41)22-9-7-8-21(18-22)24-19-25-27(30(42)37-4)28(43-31(25)38-26(24)14-15-33(34,35)36)20-10-12-23(13-11-20)40-16-5-6-17-40;1-31(2,3)39-28(41)21-8-5-7-20(17-21)23-18-24-26(29(42)36-4)27(43-30(24)38-25(23)13-14-32(33,34)35)19-9-11-22(12-10-19)40-16-6-15-37-40/h6-12,14,16-18H,13,15H2,1-5H3,(H,37,43)(H,39,42);2*6-12,15-18H,13-14H2,1-5H3,(H,37,43)(H,40,42);5-13,16-19H,14-15H2,1-4H3,(H,37,42)(H,39,41);5-12,15-18H,13-14H2,1-4H3,(H,36,42)(H,39,41).
What are the key properties of 5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-[4-(4-methylimidazol-1-yl)phenyl]-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide;5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-[4-(3-methylpyrazol-1-yl)phenyl]-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide;5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-[4-(4-methylpyrazol-1-yl)phenyl]-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide;5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-(4-pyrazol-1-ylphenyl)-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide;5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-(4-pyrrol-1-ylphenyl)-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide?
5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-[4-(4-methylimidazol-1-yl)phenyl]-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide;5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-[4-(3-methylpyrazol-1-yl)phenyl]-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide;5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-[4-(4-methylpyrazol-1-yl)phenyl]-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide;5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-(4-pyrazol-1-ylphenyl)-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide;5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-(4-pyrrol-1-ylphenyl)-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide has a molecular weight of 2989.18 g/mol, XLogP of 35.18, 35 rotatable bonds, 10 hydrogen bond donors, and 29 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-[4-(4-methylimidazol-1-yl)phenyl]-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide;5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-[4-(3-methylpyrazol-1-yl)phenyl]-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide;5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-[4-(4-methylpyrazol-1-yl)phenyl]-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide;5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-(4-pyrazol-1-ylphenyl)-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide;5-[3-(tert-butylcarbamoyl)phenyl]-N-methyl-2-(4-pyrrol-1-ylphenyl)-6-(3,3,3-trifluoropropyl)furo[2,3-b]pyridine-3-carboxamide is sourced from PubChem (CID 158318002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).