N-(2,6-difluorophenyl)-5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;N-(2,6-difluorophenyl)-5-(1-methyl-3-phenylpyrazol-5-yl)thiophene-2-carboxamide;N-(2,6-difluorophenyl)-5-[1-methyl-3-(1,3-thiazol-2-yl)pyrazol-5-yl]thiophene-2-carboxamide;N-(3-fluoro-5-methyl-2-pyridinyl)-5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;N-(3-fluoro-5-methyl-2-pyridinyl)-5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;N-(2-fluorophenyl)-5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;N-(2-fluorophenyl)-5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]-N-(3-fluoro-2-pyridinyl)thiophene-2-carboxamide;N-(3-fluoro-2-pyridinyl)-5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide

C178H128F16N32O12S10 — CID 162120097

IUPACN-(2,6-difluorophenyl)-5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;N-(2,6-difluorophenyl)-5-(1-methyl-3-phenylpyrazol-5-yl)thiophene-2-carboxamide;N-(2,6-difluorophenyl)-5-[1-methyl-3-(1,3-thiazol-2-yl)pyrazol-5-yl]thiophene-2-carboxamide;N-(3-fluoro-5-methyl-2-pyridinyl)-5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;N-(3-fluoro-5-methyl-2-pyridinyl)-5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;N-(2-fluorophenyl)-5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;N-(2-fluorophenyl)-5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]-N-(3-fluoro-2-pyridinyl)thiophene-2-carboxamide;N-(3-fluoro-2-pyridinyl)-5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide
SMILESCc1cnc(NC(=O)c2ccc(-c3cc(-c4ccccc4F)nn3C)s2)c(F)c1.Cc1cnc(NC(=O)c2ccc(-c3cc(-c4ccco4)nn3C)s2)c(F)c1.Cn1nc(-c2ccccc2)cc1-c1ccc(C(=O)Nc2c(F)cccc2F)s1.Cn1nc(-c2ccccc2F)cc1-c1ccc(C(=O)Nc2c(F)cccc2F)s1.Cn1nc(-c2ccccc2F)cc1-c1ccc(C(=O)Nc2ccccc2F)s1.Cn1nc(-c2ccccc2F)cc1-c1ccc(C(=O)Nc2ncccc2F)s1.Cn1nc(-c2ccco2)cc1-c1ccc(C(=O)Nc2ccccc2F)s1.Cn1nc(-c2ccco2)cc1-c1ccc(C(=O)Nc2ncccc2F)s1.Cn1nc(-c2nccs2)cc1-c1ccc(C(=O)Nc2c(F)cccc2F)s1
InChIInChI=1S/C21H14F3N3OS.C21H16F2N4OS.2C21H15F2N3OS.C20H14F2N4OS.C19H15FN4O2S.C19H14FN3O2S.C18H12F2N4OS2.C18H13FN4O2S/c1-27-17(11-16(26-27)12-5-2-3-6-13(12)22)18-9-10-19(29-18)21(28)25-20-14(23)7-4-8-15(20)24;1-12-9-15(23)20(24-11-12)25-21(28)19-8-7-18(29-19)17-10-16(26-27(17)2)13-5-3-4-6-14(13)22;1-26-18(12-17(25-26)13-6-2-3-7-14(13)22)19-10-11-20(28-19)21(27)24-16-9-5-4-8-15(16)23;1-26-17(12-16(25-26)13-6-3-2-4-7-13)18-10-11-19(28-18)21(27)24-20-14(22)8-5-9-15(20)23;1-26-16(11-15(25-26)12-5-2-3-6-13(12)21)17-8-9-18(28-17)20(27)24-19-14(22)7-4-10-23-19;1-11-8-12(20)18(21-10-11)22-19(25)17-6-5-16(27-17)14-9-13(23-24(14)2)15-4-3-7-26-15;1-23-15(11-14(22-23)16-7-4-10-25-16)17-8-9-18(26-17)19(24)21-13-6-3-2-5-12(13)20;1-24-13(9-12(23-24)18-21-7-8-26-18)14-5-6-15(27-14)17(25)22-16-10(19)3-2-4-11(16)20;1-23-13(10-12(22-23)14-5-3-9-25-14)15-6-7-16(26-15)18(24)21-17-11(19)4-2-8-20-17/h2-11H,1H3,(H,25,28);3-11H,1-2H3,(H,24,25,28);2*2-12H,1H3,(H,24,27);2-11H,1H3,(H,23,24,27);3-10H,1-2H3,(H,21,22,25);2-11H,1H3,(H,21,24);2-9H,1H3,(H,22,25);2-10H,1H3,(H,20,21,24)
InChIKeyZHHHLOIBWMTRSA-UHFFFAOYSA-N
MW3531.83 g/mol
LogP44.27
Rot. Bonds36

About N-(2,6-difluorophenyl)-5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;N-(2,6-difluorophenyl)-5-(1-methyl-3-phenylpyrazol-5-yl)thiophene-2-carboxamide;N-(2,6-difluorophenyl)-5-[1-methyl-3-(1,3-thiazol-2-yl)pyrazol-5-yl]thiophene-2-carboxamide;N-(3-fluoro-5-methyl-2-pyridinyl)-5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;N-(3-fluoro-5-methyl-2-pyridinyl)-5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;N-(2-fluorophenyl)-5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;N-(2-fluorophenyl)-5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]-N-(3-fluoro-2-pyridinyl)thiophene-2-carboxamide;N-(3-fluoro-2-pyridinyl)-5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide

N-(2,6-difluorophenyl)-5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;N-(2,6-difluorophenyl)-5-(1-methyl-3-phenylpyrazol-5-yl)thiophene-2-carboxamide;N-(2,6-difluorophenyl)-5-[1-methyl-3-(1,3-thiazol-2-yl)pyrazol-5-yl]thiophene-2-carboxamide;N-(3-fluoro-5-methyl-2-pyridinyl)-5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;N-(3-fluoro-5-methyl-2-pyridinyl)-5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;N-(2-fluorophenyl)-5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;N-(2-fluorophenyl)-5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]-N-(3-fluoro-2-pyridinyl)thiophene-2-carboxamide;N-(3-fluoro-2-pyridinyl)-5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide (PubChem CID 162120097) has the molecular formula C178H128F16N32O12S10 and a molecular weight of 3531.83 g/mol. Its IUPAC name is N-(2,6-difluorophenyl)-5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;N-(2,6-difluorophenyl)-5-(1-methyl-3-phenylpyrazol-5-yl)thiophene-2-carboxamide;N-(2,6-difluorophenyl)-5-[1-methyl-3-(1,3-thiazol-2-yl)pyrazol-5-yl]thiophene-2-carboxamide;N-(3-fluoro-5-methyl-2-pyridinyl)-5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;N-(3-fluoro-5-methyl-2-pyridinyl)-5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;N-(2-fluorophenyl)-5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;N-(2-fluorophenyl)-5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]-N-(3-fluoro-2-pyridinyl)thiophene-2-carboxamide;N-(3-fluoro-2-pyridinyl)-5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide.

Molecular Properties

Compound NameN-(2,6-difluorophenyl)-5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;N-(2,6-difluorophenyl)-5-(1-methyl-3-phenylpyrazol-5-yl)thiophene-2-carboxamide;N-(2,6-difluorophenyl)-5-[1-methyl-3-(1,3-thiazol-2-yl)pyrazol-5-yl]thiophene-2-carboxamide;N-(3-fluoro-5-methyl-2-pyridinyl)-5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;N-(3-fluoro-5-methyl-2-pyridinyl)-5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;N-(2-fluorophenyl)-5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;N-(2-fluorophenyl)-5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]-N-(3-fluoro-2-pyridinyl)thiophene-2-carboxamide;N-(3-fluoro-2-pyridinyl)-5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide
PubChem CID162120097
Molecular FormulaC178H128F16N32O12S10
Molecular Weight3531.83 g/mol
Exact Mass3528.73
IUPAC NameN-(2,6-difluorophenyl)-5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;N-(2,6-difluorophenyl)-5-(1-methyl-3-phenylpyrazol-5-yl)thiophene-2-carboxamide;N-(2,6-difluorophenyl)-5-[1-methyl-3-(1,3-thiazol-2-yl)pyrazol-5-yl]thiophene-2-carboxamide;N-(3-fluoro-5-methyl-2-pyridinyl)-5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;N-(3-fluoro-5-methyl-2-pyridinyl)-5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;N-(2-fluorophenyl)-5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;N-(2-fluorophenyl)-5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]-N-(3-fluoro-2-pyridinyl)thiophene-2-carboxamide;N-(3-fluoro-2-pyridinyl)-5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide
SMILESCc1cnc(NC(=O)c2ccc(-c3cc(-c4ccccc4F)nn3C)s2)c(F)c1.Cc1cnc(NC(=O)c2ccc(-c3cc(-c4ccco4)nn3C)s2)c(F)c1.Cn1nc(-c2ccccc2)cc1-c1ccc(C(=O)Nc2c(F)cccc2F)s1.Cn1nc(-c2ccccc2F)cc1-c1ccc(C(=O)Nc2c(F)cccc2F)s1.Cn1nc(-c2ccccc2F)cc1-c1ccc(C(=O)Nc2ccccc2F)s1.Cn1nc(-c2ccccc2F)cc1-c1ccc(C(=O)Nc2ncccc2F)s1.Cn1nc(-c2ccco2)cc1-c1ccc(C(=O)Nc2ccccc2F)s1.Cn1nc(-c2ccco2)cc1-c1ccc(C(=O)Nc2ncccc2F)s1.Cn1nc(-c2nccs2)cc1-c1ccc(C(=O)Nc2c(F)cccc2F)s1
InChIInChI=1S/C21H14F3N3OS.C21H16F2N4OS.2C21H15F2N3OS.C20H14F2N4OS.C19H15FN4O2S.C19H14FN3O2S.C18H12F2N4OS2.C18H13FN4O2S/c1-27-17(11-16(26-27)12-5-2-3-6-13(12)22)18-9-10-19(29-18)21(28)25-20-14(23)7-4-8-15(20)24;1-12-9-15(23)20(24-11-12)25-21(28)19-8-7-18(29-19)17-10-16(26-27(17)2)13-5-3-4-6-14(13)22;1-26-18(12-17(25-26)13-6-2-3-7-14(13)22)19-10-11-20(28-19)21(27)24-16-9-5-4-8-15(16)23;1-26-17(12-16(25-26)13-6-3-2-4-7-13)18-10-11-19(28-18)21(27)24-20-14(22)8-5-9-15(20)23;1-26-16(11-15(25-26)12-5-2-3-6-13(12)21)17-8-9-18(28-17)20(27)24-19-14(22)7-4-10-23-19;1-11-8-12(20)18(21-10-11)22-19(25)17-6-5-16(27-17)14-9-13(23-24(14)2)15-4-3-7-26-15;1-23-15(11-14(22-23)16-7-4-10-25-16)17-8-9-18(26-17)19(24)21-13-6-3-2-5-12(13)20;1-24-13(9-12(23-24)18-21-7-8-26-18)14-5-6-15(27-14)17(25)22-16-10(19)3-2-4-11(16)20;1-23-13(10-12(22-23)14-5-3-9-25-14)15-6-7-16(26-15)18(24)21-17-11(19)4-2-8-20-17/h2-11H,1H3,(H,25,28);3-11H,1-2H3,(H,24,25,28);2*2-12H,1H3,(H,24,27);2-11H,1H3,(H,23,24,27);3-10H,1-2H3,(H,21,22,25);2-11H,1H3,(H,21,24);2-9H,1H3,(H,22,25);2-10H,1H3,(H,20,21,24)
InChIKeyZHHHLOIBWMTRSA-UHFFFAOYSA-N
XLogP44.27
TPSA526.15 Ų
H-Bond Donors9
H-Bond Acceptors45
Rotatable Bonds36
Heavy Atoms248
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003531.83
LogP ≤ 544.27
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 1045

Analyze N-(2,6-difluorophenyl)-5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;N-(2,6-difluorophenyl)-5-(1-methyl-3-phenylpyrazol-5-yl)thiophene-2-carboxamide;N-(2,6-difluorophenyl)-5-[1-methyl-3-(1,3-thiazol-2-yl)pyrazol-5-yl]thiophene-2-carboxamide;N-(3-fluoro-5-methyl-2-pyridinyl)-5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;N-(3-fluoro-5-methyl-2-pyridinyl)-5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;N-(2-fluorophenyl)-5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;N-(2-fluorophenyl)-5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]-N-(3-fluoro-2-pyridinyl)thiophene-2-carboxamide;N-(3-fluoro-2-pyridinyl)-5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-(2,6-difluorophenyl)-5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;N-(2,6-difluorophenyl)-5-(1-methyl-3-phenylpyrazol-5-yl)thiophene-2-carboxamide;N-(2,6-difluorophenyl)-5-[1-methyl-3-(1,3-thiazol-2-yl)pyrazol-5-yl]thiophene-2-carboxamide;N-(3-fluoro-5-methyl-2-pyridinyl)-5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;N-(3-fluoro-5-methyl-2-pyridinyl)-5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;N-(2-fluorophenyl)-5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;N-(2-fluorophenyl)-5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]-N-(3-fluoro-2-pyridinyl)thiophene-2-carboxamide;N-(3-fluoro-2-pyridinyl)-5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide?
The IUPAC name of N-(2,6-difluorophenyl)-5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;N-(2,6-difluorophenyl)-5-(1-methyl-3-phenylpyrazol-5-yl)thiophene-2-carboxamide;N-(2,6-difluorophenyl)-5-[1-methyl-3-(1,3-thiazol-2-yl)pyrazol-5-yl]thiophene-2-carboxamide;N-(3-fluoro-5-methyl-2-pyridinyl)-5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;N-(3-fluoro-5-methyl-2-pyridinyl)-5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;N-(2-fluorophenyl)-5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;N-(2-fluorophenyl)-5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]-N-(3-fluoro-2-pyridinyl)thiophene-2-carboxamide;N-(3-fluoro-2-pyridinyl)-5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide (CID 162120097) is N-(2,6-difluorophenyl)-5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;N-(2,6-difluorophenyl)-5-(1-methyl-3-phenylpyrazol-5-yl)thiophene-2-carboxamide;N-(2,6-difluorophenyl)-5-[1-methyl-3-(1,3-thiazol-2-yl)pyrazol-5-yl]thiophene-2-carboxamide;N-(3-fluoro-5-methyl-2-pyridinyl)-5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;N-(3-fluoro-5-methyl-2-pyridinyl)-5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;N-(2-fluorophenyl)-5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;N-(2-fluorophenyl)-5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]-N-(3-fluoro-2-pyridinyl)thiophene-2-carboxamide;N-(3-fluoro-2-pyridinyl)-5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide.
What is the SMILES notation for N-(2,6-difluorophenyl)-5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;N-(2,6-difluorophenyl)-5-(1-methyl-3-phenylpyrazol-5-yl)thiophene-2-carboxamide;N-(2,6-difluorophenyl)-5-[1-methyl-3-(1,3-thiazol-2-yl)pyrazol-5-yl]thiophene-2-carboxamide;N-(3-fluoro-5-methyl-2-pyridinyl)-5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;N-(3-fluoro-5-methyl-2-pyridinyl)-5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;N-(2-fluorophenyl)-5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;N-(2-fluorophenyl)-5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]-N-(3-fluoro-2-pyridinyl)thiophene-2-carboxamide;N-(3-fluoro-2-pyridinyl)-5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide?
The canonical SMILES for N-(2,6-difluorophenyl)-5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;N-(2,6-difluorophenyl)-5-(1-methyl-3-phenylpyrazol-5-yl)thiophene-2-carboxamide;N-(2,6-difluorophenyl)-5-[1-methyl-3-(1,3-thiazol-2-yl)pyrazol-5-yl]thiophene-2-carboxamide;N-(3-fluoro-5-methyl-2-pyridinyl)-5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;N-(3-fluoro-5-methyl-2-pyridinyl)-5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;N-(2-fluorophenyl)-5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;N-(2-fluorophenyl)-5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]-N-(3-fluoro-2-pyridinyl)thiophene-2-carboxamide;N-(3-fluoro-2-pyridinyl)-5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide is Cc1cnc(NC(=O)c2ccc(-c3cc(-c4ccccc4F)nn3C)s2)c(F)c1.Cc1cnc(NC(=O)c2ccc(-c3cc(-c4ccco4)nn3C)s2)c(F)c1.Cn1nc(-c2ccccc2)cc1-c1ccc(C(=O)Nc2c(F)cccc2F)s1.Cn1nc(-c2ccccc2F)cc1-c1ccc(C(=O)Nc2c(F)cccc2F)s1.Cn1nc(-c2ccccc2F)cc1-c1ccc(C(=O)Nc2ccccc2F)s1.Cn1nc(-c2ccccc2F)cc1-c1ccc(C(=O)Nc2ncccc2F)s1.Cn1nc(-c2ccco2)cc1-c1ccc(C(=O)Nc2ccccc2F)s1.Cn1nc(-c2ccco2)cc1-c1ccc(C(=O)Nc2ncccc2F)s1.Cn1nc(-c2nccs2)cc1-c1ccc(C(=O)Nc2c(F)cccc2F)s1.
What is the InChIKey of N-(2,6-difluorophenyl)-5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;N-(2,6-difluorophenyl)-5-(1-methyl-3-phenylpyrazol-5-yl)thiophene-2-carboxamide;N-(2,6-difluorophenyl)-5-[1-methyl-3-(1,3-thiazol-2-yl)pyrazol-5-yl]thiophene-2-carboxamide;N-(3-fluoro-5-methyl-2-pyridinyl)-5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;N-(3-fluoro-5-methyl-2-pyridinyl)-5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;N-(2-fluorophenyl)-5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;N-(2-fluorophenyl)-5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]-N-(3-fluoro-2-pyridinyl)thiophene-2-carboxamide;N-(3-fluoro-2-pyridinyl)-5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide?
The InChIKey is ZHHHLOIBWMTRSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H14F3N3OS.C21H16F2N4OS.2C21H15F2N3OS.C20H14F2N4OS.C19H15FN4O2S.C19H14FN3O2S.C18H12F2N4OS2.C18H13FN4O2S/c1-27-17(11-16(26-27)12-5-2-3-6-13(12)22)18-9-10-19(29-18)21(28)25-20-14(23)7-4-8-15(20)24;1-12-9-15(23)20(24-11-12)25-21(28)19-8-7-18(29-19)17-10-16(26-27(17)2)13-5-3-4-6-14(13)22;1-26-18(12-17(25-26)13-6-2-3-7-14(13)22)19-10-11-20(28-19)21(27)24-16-9-5-4-8-15(16)23;1-26-17(12-16(25-26)13-6-3-2-4-7-13)18-10-11-19(28-18)21(27)24-20-14(22)8-5-9-15(20)23;1-26-16(11-15(25-26)12-5-2-3-6-13(12)21)17-8-9-18(28-17)20(27)24-19-14(22)7-4-10-23-19;1-11-8-12(20)18(21-10-11)22-19(25)17-6-5-16(27-17)14-9-13(23-24(14)2)15-4-3-7-26-15;1-23-15(11-14(22-23)16-7-4-10-25-16)17-8-9-18(26-17)19(24)21-13-6-3-2-5-12(13)20;1-24-13(9-12(23-24)18-21-7-8-26-18)14-5-6-15(27-14)17(25)22-16-10(19)3-2-4-11(16)20;1-23-13(10-12(22-23)14-5-3-9-25-14)15-6-7-16(26-15)18(24)21-17-11(19)4-2-8-20-17/h2-11H,1H3,(H,25,28);3-11H,1-2H3,(H,24,25,28);2*2-12H,1H3,(H,24,27);2-11H,1H3,(H,23,24,27);3-10H,1-2H3,(H,21,22,25);2-11H,1H3,(H,21,24);2-9H,1H3,(H,22,25);2-10H,1H3,(H,20,21,24).
What are the key properties of N-(2,6-difluorophenyl)-5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;N-(2,6-difluorophenyl)-5-(1-methyl-3-phenylpyrazol-5-yl)thiophene-2-carboxamide;N-(2,6-difluorophenyl)-5-[1-methyl-3-(1,3-thiazol-2-yl)pyrazol-5-yl]thiophene-2-carboxamide;N-(3-fluoro-5-methyl-2-pyridinyl)-5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;N-(3-fluoro-5-methyl-2-pyridinyl)-5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;N-(2-fluorophenyl)-5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;N-(2-fluorophenyl)-5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]-N-(3-fluoro-2-pyridinyl)thiophene-2-carboxamide;N-(3-fluoro-2-pyridinyl)-5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide?
N-(2,6-difluorophenyl)-5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;N-(2,6-difluorophenyl)-5-(1-methyl-3-phenylpyrazol-5-yl)thiophene-2-carboxamide;N-(2,6-difluorophenyl)-5-[1-methyl-3-(1,3-thiazol-2-yl)pyrazol-5-yl]thiophene-2-carboxamide;N-(3-fluoro-5-methyl-2-pyridinyl)-5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;N-(3-fluoro-5-methyl-2-pyridinyl)-5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;N-(2-fluorophenyl)-5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;N-(2-fluorophenyl)-5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]-N-(3-fluoro-2-pyridinyl)thiophene-2-carboxamide;N-(3-fluoro-2-pyridinyl)-5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide has a molecular weight of 3531.83 g/mol, XLogP of 44.27, 36 rotatable bonds, 9 hydrogen bond donors, and 45 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-difluorophenyl)-5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;N-(2,6-difluorophenyl)-5-(1-methyl-3-phenylpyrazol-5-yl)thiophene-2-carboxamide;N-(2,6-difluorophenyl)-5-[1-methyl-3-(1,3-thiazol-2-yl)pyrazol-5-yl]thiophene-2-carboxamide;N-(3-fluoro-5-methyl-2-pyridinyl)-5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;N-(3-fluoro-5-methyl-2-pyridinyl)-5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;N-(2-fluorophenyl)-5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;N-(2-fluorophenyl)-5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]-N-(3-fluoro-2-pyridinyl)thiophene-2-carboxamide;N-(3-fluoro-2-pyridinyl)-5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide is sourced from PubChem (CID 162120097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).