6-(difluoromethoxy)-N-[3-fluoro-4-[1-methyl-6-(1H-pyrazol-4-yl)indazol-5-yl]oxyphenyl]-1-(4-fluorophenyl)-2-oxopyridine-3-carboxamide;6-(difluoromethoxy)-1-(4-fluorophenyl)-N-[3-fluoro-4-[[8-(1H-pyrazol-4-yl)-3,4-diazatricyclo[5.3.1.04,11]undeca-1(10),2,7(11),8-tetraen-9-yl]oxy]phenyl]-2-oxopyridine-3-carboxamide;N-[3-fluoro-4-[1-methyl-6-(1H-pyrazol-4-yl)indazol-5-yl]oxyphenyl]-1-(4-fluorophenyl)-2-oxo-6-(trifluoromethoxy)pyridine-3-carboxamide

C91H59F13N18O12 — CID 167588781

IUPAC6-(difluoromethoxy)-N-[3-fluoro-4-[1-methyl-6-(1H-pyrazol-4-yl)indazol-5-yl]oxyphenyl]-1-(4-fluorophenyl)-2-oxopyridine-3-carboxamide;6-(difluoromethoxy)-1-(4-fluorophenyl)-N-[3-fluoro-4-[[8-(1H-pyrazol-4-yl)-3,4-diazatricyclo[5.3.1.04,11]undeca-1(10),2,7(11),8-tetraen-9-yl]oxy]phenyl]-2-oxopyridine-3-carboxamide;N-[3-fluoro-4-[1-methyl-6-(1H-pyrazol-4-yl)indazol-5-yl]oxyphenyl]-1-(4-fluorophenyl)-2-oxo-6-(trifluoromethoxy)pyridine-3-carboxamide
SMILESCn1ncc2cc(Oc3ccc(NC(=O)c4ccc(OC(F)(F)F)n(-c5ccc(F)cc5)c4=O)cc3F)c(-c3cn[nH]c3)cc21.Cn1ncc2cc(Oc3ccc(NC(=O)c4ccc(OC(F)F)n(-c5ccc(F)cc5)c4=O)cc3F)c(-c3cn[nH]c3)cc21.O=C(Nc1ccc(Oc2cc3cnn4c3c(c2-c2cn[nH]c2)CC4)c(F)c1)c1ccc(OC(F)F)n(-c2ccc(F)cc2)c1=O
InChIInChI=1S/C31H20F4N6O4.C30H19F5N6O4.C30H20F4N6O4/c32-18-1-4-20(5-2-18)41-26(45-31(34)35)8-6-22(30(41)43)29(42)39-19-3-7-24(23(33)12-19)44-25-11-16-15-38-40-10-9-21(28(16)40)27(25)17-13-36-37-14-17;1-40-24-12-22(17-13-36-37-14-17)26(10-16(24)15-38-40)44-25-8-4-19(11-23(25)32)39-28(42)21-7-9-27(45-30(33,34)35)41(29(21)43)20-5-2-18(31)3-6-20;1-39-24-12-22(17-13-35-36-14-17)26(10-16(24)15-37-39)43-25-8-4-19(11-23(25)32)38-28(41)21-7-9-27(44-30(33)34)40(29(21)42)20-5-2-18(31)3-6-20/h1-8,11-15,31H,9-10H2,(H,36,37)(H,39,42);2-15H,1H3,(H,36,37)(H,39,42);2-15,30H,1H3,(H,35,36)(H,38,41)
InChIKeyIDPDATIWGAIZHE-UHFFFAOYSA-N
MW1843.56 g/mol
LogP18.43
Rot. Bonds23

About 6-(difluoromethoxy)-N-[3-fluoro-4-[1-methyl-6-(1H-pyrazol-4-yl)indazol-5-yl]oxyphenyl]-1-(4-fluorophenyl)-2-oxopyridine-3-carboxamide;6-(difluoromethoxy)-1-(4-fluorophenyl)-N-[3-fluoro-4-[[8-(1H-pyrazol-4-yl)-3,4-diazatricyclo[5.3.1.04,11]undeca-1(10),2,7(11),8-tetraen-9-yl]oxy]phenyl]-2-oxopyridine-3-carboxamide;N-[3-fluoro-4-[1-methyl-6-(1H-pyrazol-4-yl)indazol-5-yl]oxyphenyl]-1-(4-fluorophenyl)-2-oxo-6-(trifluoromethoxy)pyridine-3-carboxamide

6-(difluoromethoxy)-N-[3-fluoro-4-[1-methyl-6-(1H-pyrazol-4-yl)indazol-5-yl]oxyphenyl]-1-(4-fluorophenyl)-2-oxopyridine-3-carboxamide;6-(difluoromethoxy)-1-(4-fluorophenyl)-N-[3-fluoro-4-[[8-(1H-pyrazol-4-yl)-3,4-diazatricyclo[5.3.1.04,11]undeca-1(10),2,7(11),8-tetraen-9-yl]oxy]phenyl]-2-oxopyridine-3-carboxamide;N-[3-fluoro-4-[1-methyl-6-(1H-pyrazol-4-yl)indazol-5-yl]oxyphenyl]-1-(4-fluorophenyl)-2-oxo-6-(trifluoromethoxy)pyridine-3-carboxamide (PubChem CID 167588781) has the molecular formula C91H59F13N18O12 and a molecular weight of 1843.56 g/mol. Its IUPAC name is 6-(difluoromethoxy)-N-[3-fluoro-4-[1-methyl-6-(1H-pyrazol-4-yl)indazol-5-yl]oxyphenyl]-1-(4-fluorophenyl)-2-oxopyridine-3-carboxamide;6-(difluoromethoxy)-1-(4-fluorophenyl)-N-[3-fluoro-4-[[8-(1H-pyrazol-4-yl)-3,4-diazatricyclo[5.3.1.04,11]undeca-1(10),2,7(11),8-tetraen-9-yl]oxy]phenyl]-2-oxopyridine-3-carboxamide;N-[3-fluoro-4-[1-methyl-6-(1H-pyrazol-4-yl)indazol-5-yl]oxyphenyl]-1-(4-fluorophenyl)-2-oxo-6-(trifluoromethoxy)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-(difluoromethoxy)-N-[3-fluoro-4-[1-methyl-6-(1H-pyrazol-4-yl)indazol-5-yl]oxyphenyl]-1-(4-fluorophenyl)-2-oxopyridine-3-carboxamide;6-(difluoromethoxy)-1-(4-fluorophenyl)-N-[3-fluoro-4-[[8-(1H-pyrazol-4-yl)-3,4-diazatricyclo[5.3.1.04,11]undeca-1(10),2,7(11),8-tetraen-9-yl]oxy]phenyl]-2-oxopyridine-3-carboxamide;N-[3-fluoro-4-[1-methyl-6-(1H-pyrazol-4-yl)indazol-5-yl]oxyphenyl]-1-(4-fluorophenyl)-2-oxo-6-(trifluoromethoxy)pyridine-3-carboxamide
PubChem CID167588781
Molecular FormulaC91H59F13N18O12
Molecular Weight1843.56 g/mol
Exact Mass1842.44
IUPAC Name6-(difluoromethoxy)-N-[3-fluoro-4-[1-methyl-6-(1H-pyrazol-4-yl)indazol-5-yl]oxyphenyl]-1-(4-fluorophenyl)-2-oxopyridine-3-carboxamide;6-(difluoromethoxy)-1-(4-fluorophenyl)-N-[3-fluoro-4-[[8-(1H-pyrazol-4-yl)-3,4-diazatricyclo[5.3.1.04,11]undeca-1(10),2,7(11),8-tetraen-9-yl]oxy]phenyl]-2-oxopyridine-3-carboxamide;N-[3-fluoro-4-[1-methyl-6-(1H-pyrazol-4-yl)indazol-5-yl]oxyphenyl]-1-(4-fluorophenyl)-2-oxo-6-(trifluoromethoxy)pyridine-3-carboxamide
SMILESCn1ncc2cc(Oc3ccc(NC(=O)c4ccc(OC(F)(F)F)n(-c5ccc(F)cc5)c4=O)cc3F)c(-c3cn[nH]c3)cc21.Cn1ncc2cc(Oc3ccc(NC(=O)c4ccc(OC(F)F)n(-c5ccc(F)cc5)c4=O)cc3F)c(-c3cn[nH]c3)cc21.O=C(Nc1ccc(Oc2cc3cnn4c3c(c2-c2cn[nH]c2)CC4)c(F)c1)c1ccc(OC(F)F)n(-c2ccc(F)cc2)c1=O
InChIInChI=1S/C31H20F4N6O4.C30H19F5N6O4.C30H20F4N6O4/c32-18-1-4-20(5-2-18)41-26(45-31(34)35)8-6-22(30(41)43)29(42)39-19-3-7-24(23(33)12-19)44-25-11-16-15-38-40-10-9-21(28(16)40)27(25)17-13-36-37-14-17;1-40-24-12-22(17-13-36-37-14-17)26(10-16(24)15-38-40)44-25-8-4-19(11-23(25)32)39-28(42)21-7-9-27(45-30(33,34)35)41(29(21)43)20-5-2-18(31)3-6-20;1-39-24-12-22(17-13-35-36-14-17)26(10-16(24)15-37-39)43-25-8-4-19(11-23(25)32)38-28(41)21-7-9-27(44-30(33)34)40(29(21)42)20-5-2-18(31)3-6-20/h1-8,11-15,31H,9-10H2,(H,36,37)(H,39,42);2-15H,1H3,(H,36,37)(H,39,42);2-15,30H,1H3,(H,35,36)(H,38,41)
InChIKeyIDPDATIWGAIZHE-UHFFFAOYSA-N
XLogP18.43
TPSA348.18 Ų
H-Bond Donors6
H-Bond Acceptors24
Rotatable Bonds23
Heavy Atoms134
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001843.56
LogP ≤ 518.43
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1024

Analyze 6-(difluoromethoxy)-N-[3-fluoro-4-[1-methyl-6-(1H-pyrazol-4-yl)indazol-5-yl]oxyphenyl]-1-(4-fluorophenyl)-2-oxopyridine-3-carboxamide;6-(difluoromethoxy)-1-(4-fluorophenyl)-N-[3-fluoro-4-[[8-(1H-pyrazol-4-yl)-3,4-diazatricyclo[5.3.1.04,11]undeca-1(10),2,7(11),8-tetraen-9-yl]oxy]phenyl]-2-oxopyridine-3-carboxamide;N-[3-fluoro-4-[1-methyl-6-(1H-pyrazol-4-yl)indazol-5-yl]oxyphenyl]-1-(4-fluorophenyl)-2-oxo-6-(trifluoromethoxy)pyridine-3-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 6-(difluoromethoxy)-N-[3-fluoro-4-[1-methyl-6-(1H-pyrazol-4-yl)indazol-5-yl]oxyphenyl]-1-(4-fluorophenyl)-2-oxopyridine-3-carboxamide;6-(difluoromethoxy)-1-(4-fluorophenyl)-N-[3-fluoro-4-[[8-(1H-pyrazol-4-yl)-3,4-diazatricyclo[5.3.1.04,11]undeca-1(10),2,7(11),8-tetraen-9-yl]oxy]phenyl]-2-oxopyridine-3-carboxamide;N-[3-fluoro-4-[1-methyl-6-(1H-pyrazol-4-yl)indazol-5-yl]oxyphenyl]-1-(4-fluorophenyl)-2-oxo-6-(trifluoromethoxy)pyridine-3-carboxamide?
The IUPAC name of 6-(difluoromethoxy)-N-[3-fluoro-4-[1-methyl-6-(1H-pyrazol-4-yl)indazol-5-yl]oxyphenyl]-1-(4-fluorophenyl)-2-oxopyridine-3-carboxamide;6-(difluoromethoxy)-1-(4-fluorophenyl)-N-[3-fluoro-4-[[8-(1H-pyrazol-4-yl)-3,4-diazatricyclo[5.3.1.04,11]undeca-1(10),2,7(11),8-tetraen-9-yl]oxy]phenyl]-2-oxopyridine-3-carboxamide;N-[3-fluoro-4-[1-methyl-6-(1H-pyrazol-4-yl)indazol-5-yl]oxyphenyl]-1-(4-fluorophenyl)-2-oxo-6-(trifluoromethoxy)pyridine-3-carboxamide (CID 167588781) is 6-(difluoromethoxy)-N-[3-fluoro-4-[1-methyl-6-(1H-pyrazol-4-yl)indazol-5-yl]oxyphenyl]-1-(4-fluorophenyl)-2-oxopyridine-3-carboxamide;6-(difluoromethoxy)-1-(4-fluorophenyl)-N-[3-fluoro-4-[[8-(1H-pyrazol-4-yl)-3,4-diazatricyclo[5.3.1.04,11]undeca-1(10),2,7(11),8-tetraen-9-yl]oxy]phenyl]-2-oxopyridine-3-carboxamide;N-[3-fluoro-4-[1-methyl-6-(1H-pyrazol-4-yl)indazol-5-yl]oxyphenyl]-1-(4-fluorophenyl)-2-oxo-6-(trifluoromethoxy)pyridine-3-carboxamide.
What is the SMILES notation for 6-(difluoromethoxy)-N-[3-fluoro-4-[1-methyl-6-(1H-pyrazol-4-yl)indazol-5-yl]oxyphenyl]-1-(4-fluorophenyl)-2-oxopyridine-3-carboxamide;6-(difluoromethoxy)-1-(4-fluorophenyl)-N-[3-fluoro-4-[[8-(1H-pyrazol-4-yl)-3,4-diazatricyclo[5.3.1.04,11]undeca-1(10),2,7(11),8-tetraen-9-yl]oxy]phenyl]-2-oxopyridine-3-carboxamide;N-[3-fluoro-4-[1-methyl-6-(1H-pyrazol-4-yl)indazol-5-yl]oxyphenyl]-1-(4-fluorophenyl)-2-oxo-6-(trifluoromethoxy)pyridine-3-carboxamide?
The canonical SMILES for 6-(difluoromethoxy)-N-[3-fluoro-4-[1-methyl-6-(1H-pyrazol-4-yl)indazol-5-yl]oxyphenyl]-1-(4-fluorophenyl)-2-oxopyridine-3-carboxamide;6-(difluoromethoxy)-1-(4-fluorophenyl)-N-[3-fluoro-4-[[8-(1H-pyrazol-4-yl)-3,4-diazatricyclo[5.3.1.04,11]undeca-1(10),2,7(11),8-tetraen-9-yl]oxy]phenyl]-2-oxopyridine-3-carboxamide;N-[3-fluoro-4-[1-methyl-6-(1H-pyrazol-4-yl)indazol-5-yl]oxyphenyl]-1-(4-fluorophenyl)-2-oxo-6-(trifluoromethoxy)pyridine-3-carboxamide is Cn1ncc2cc(Oc3ccc(NC(=O)c4ccc(OC(F)(F)F)n(-c5ccc(F)cc5)c4=O)cc3F)c(-c3cn[nH]c3)cc21.Cn1ncc2cc(Oc3ccc(NC(=O)c4ccc(OC(F)F)n(-c5ccc(F)cc5)c4=O)cc3F)c(-c3cn[nH]c3)cc21.O=C(Nc1ccc(Oc2cc3cnn4c3c(c2-c2cn[nH]c2)CC4)c(F)c1)c1ccc(OC(F)F)n(-c2ccc(F)cc2)c1=O.
What is the InChIKey of 6-(difluoromethoxy)-N-[3-fluoro-4-[1-methyl-6-(1H-pyrazol-4-yl)indazol-5-yl]oxyphenyl]-1-(4-fluorophenyl)-2-oxopyridine-3-carboxamide;6-(difluoromethoxy)-1-(4-fluorophenyl)-N-[3-fluoro-4-[[8-(1H-pyrazol-4-yl)-3,4-diazatricyclo[5.3.1.04,11]undeca-1(10),2,7(11),8-tetraen-9-yl]oxy]phenyl]-2-oxopyridine-3-carboxamide;N-[3-fluoro-4-[1-methyl-6-(1H-pyrazol-4-yl)indazol-5-yl]oxyphenyl]-1-(4-fluorophenyl)-2-oxo-6-(trifluoromethoxy)pyridine-3-carboxamide?
The InChIKey is IDPDATIWGAIZHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H20F4N6O4.C30H19F5N6O4.C30H20F4N6O4/c32-18-1-4-20(5-2-18)41-26(45-31(34)35)8-6-22(30(41)43)29(42)39-19-3-7-24(23(33)12-19)44-25-11-16-15-38-40-10-9-21(28(16)40)27(25)17-13-36-37-14-17;1-40-24-12-22(17-13-36-37-14-17)26(10-16(24)15-38-40)44-25-8-4-19(11-23(25)32)39-28(42)21-7-9-27(45-30(33,34)35)41(29(21)43)20-5-2-18(31)3-6-20;1-39-24-12-22(17-13-35-36-14-17)26(10-16(24)15-37-39)43-25-8-4-19(11-23(25)32)38-28(41)21-7-9-27(44-30(33)34)40(29(21)42)20-5-2-18(31)3-6-20/h1-8,11-15,31H,9-10H2,(H,36,37)(H,39,42);2-15H,1H3,(H,36,37)(H,39,42);2-15,30H,1H3,(H,35,36)(H,38,41).
What are the key properties of 6-(difluoromethoxy)-N-[3-fluoro-4-[1-methyl-6-(1H-pyrazol-4-yl)indazol-5-yl]oxyphenyl]-1-(4-fluorophenyl)-2-oxopyridine-3-carboxamide;6-(difluoromethoxy)-1-(4-fluorophenyl)-N-[3-fluoro-4-[[8-(1H-pyrazol-4-yl)-3,4-diazatricyclo[5.3.1.04,11]undeca-1(10),2,7(11),8-tetraen-9-yl]oxy]phenyl]-2-oxopyridine-3-carboxamide;N-[3-fluoro-4-[1-methyl-6-(1H-pyrazol-4-yl)indazol-5-yl]oxyphenyl]-1-(4-fluorophenyl)-2-oxo-6-(trifluoromethoxy)pyridine-3-carboxamide?
6-(difluoromethoxy)-N-[3-fluoro-4-[1-methyl-6-(1H-pyrazol-4-yl)indazol-5-yl]oxyphenyl]-1-(4-fluorophenyl)-2-oxopyridine-3-carboxamide;6-(difluoromethoxy)-1-(4-fluorophenyl)-N-[3-fluoro-4-[[8-(1H-pyrazol-4-yl)-3,4-diazatricyclo[5.3.1.04,11]undeca-1(10),2,7(11),8-tetraen-9-yl]oxy]phenyl]-2-oxopyridine-3-carboxamide;N-[3-fluoro-4-[1-methyl-6-(1H-pyrazol-4-yl)indazol-5-yl]oxyphenyl]-1-(4-fluorophenyl)-2-oxo-6-(trifluoromethoxy)pyridine-3-carboxamide has a molecular weight of 1843.56 g/mol, XLogP of 18.43, 23 rotatable bonds, 6 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(difluoromethoxy)-N-[3-fluoro-4-[1-methyl-6-(1H-pyrazol-4-yl)indazol-5-yl]oxyphenyl]-1-(4-fluorophenyl)-2-oxopyridine-3-carboxamide;6-(difluoromethoxy)-1-(4-fluorophenyl)-N-[3-fluoro-4-[[8-(1H-pyrazol-4-yl)-3,4-diazatricyclo[5.3.1.04,11]undeca-1(10),2,7(11),8-tetraen-9-yl]oxy]phenyl]-2-oxopyridine-3-carboxamide;N-[3-fluoro-4-[1-methyl-6-(1H-pyrazol-4-yl)indazol-5-yl]oxyphenyl]-1-(4-fluorophenyl)-2-oxo-6-(trifluoromethoxy)pyridine-3-carboxamide is sourced from PubChem (CID 167588781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).