2,6-difluoro-N-[5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-(1-methyl-4-phenylpyrrol-2-yl)-2-pyridinyl]benzamide;2,6-difluoro-N-[5-[1-methyl-3-(1,3-thiazol-2-yl)pyrazol-5-yl]pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)pyrazin-2-yl]benzamide

C100H69F11N24O6S2 — CID 159306591

IUPAC2,6-difluoro-N-[5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-(1-methyl-4-phenylpyrrol-2-yl)-2-pyridinyl]benzamide;2,6-difluoro-N-[5-[1-methyl-3-(1,3-thiazol-2-yl)pyrazol-5-yl]pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)pyrazin-2-yl]benzamide
SMILESCn1cc(-c2ccccc2)cc1-c1ccc(NC(=O)c2c(F)cccc2F)nc1.Cn1nc(-c2ccccc2F)cc1-c1cnc(NC(=O)c2c(F)cccc2F)cn1.Cn1nc(-c2ccco2)cc1-c1cnc(NC(=O)c2c(F)cccc2F)cn1.Cn1nc(-c2cccs2)cc1-c1cnc(NC(=O)c2c(F)cccc2F)cn1.Cn1nc(-c2nccs2)cc1-c1cnc(NC(=O)c2c(F)cccc2F)cn1
InChIInChI=1S/C23H17F2N3O.C21H14F3N5O.C19H13F2N5O2.C19H13F2N5OS.C18H12F2N6OS/c1-28-14-17(15-6-3-2-4-7-15)12-20(28)16-10-11-21(26-13-16)27-23(29)22-18(24)8-5-9-19(22)25;1-29-18(9-16(28-29)12-5-2-3-6-13(12)22)17-10-26-19(11-25-17)27-21(30)20-14(23)7-4-8-15(20)24;2*1-26-15(8-13(25-26)16-6-3-7-28-16)14-9-23-17(10-22-14)24-19(27)18-11(20)4-2-5-12(18)21;1-26-14(7-12(25-26)18-21-5-6-28-18)13-8-23-15(9-22-13)24-17(27)16-10(19)3-2-4-11(16)20/h2-14H,1H3,(H,26,27,29);2-11H,1H3,(H,26,27,30);2*2-10H,1H3,(H,23,24,27);2-9H,1H3,(H,23,24,27)
InChIKeyLBZODAHGMQBTHX-UHFFFAOYSA-N
MW1975.93 g/mol
LogP20.83
Rot. Bonds20

About 2,6-difluoro-N-[5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-(1-methyl-4-phenylpyrrol-2-yl)-2-pyridinyl]benzamide;2,6-difluoro-N-[5-[1-methyl-3-(1,3-thiazol-2-yl)pyrazol-5-yl]pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)pyrazin-2-yl]benzamide

2,6-difluoro-N-[5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-(1-methyl-4-phenylpyrrol-2-yl)-2-pyridinyl]benzamide;2,6-difluoro-N-[5-[1-methyl-3-(1,3-thiazol-2-yl)pyrazol-5-yl]pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)pyrazin-2-yl]benzamide (PubChem CID 159306591) has the molecular formula C100H69F11N24O6S2 and a molecular weight of 1975.93 g/mol. Its IUPAC name is 2,6-difluoro-N-[5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-(1-methyl-4-phenylpyrrol-2-yl)-2-pyridinyl]benzamide;2,6-difluoro-N-[5-[1-methyl-3-(1,3-thiazol-2-yl)pyrazol-5-yl]pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)pyrazin-2-yl]benzamide.

Molecular Properties

Compound Name2,6-difluoro-N-[5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-(1-methyl-4-phenylpyrrol-2-yl)-2-pyridinyl]benzamide;2,6-difluoro-N-[5-[1-methyl-3-(1,3-thiazol-2-yl)pyrazol-5-yl]pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)pyrazin-2-yl]benzamide
PubChem CID159306591
Molecular FormulaC100H69F11N24O6S2
Molecular Weight1975.93 g/mol
Exact Mass1974.51
IUPAC Name2,6-difluoro-N-[5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-(1-methyl-4-phenylpyrrol-2-yl)-2-pyridinyl]benzamide;2,6-difluoro-N-[5-[1-methyl-3-(1,3-thiazol-2-yl)pyrazol-5-yl]pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)pyrazin-2-yl]benzamide
SMILESCn1cc(-c2ccccc2)cc1-c1ccc(NC(=O)c2c(F)cccc2F)nc1.Cn1nc(-c2ccccc2F)cc1-c1cnc(NC(=O)c2c(F)cccc2F)cn1.Cn1nc(-c2ccco2)cc1-c1cnc(NC(=O)c2c(F)cccc2F)cn1.Cn1nc(-c2cccs2)cc1-c1cnc(NC(=O)c2c(F)cccc2F)cn1.Cn1nc(-c2nccs2)cc1-c1cnc(NC(=O)c2c(F)cccc2F)cn1
InChIInChI=1S/C23H17F2N3O.C21H14F3N5O.C19H13F2N5O2.C19H13F2N5OS.C18H12F2N6OS/c1-28-14-17(15-6-3-2-4-7-15)12-20(28)16-10-11-21(26-13-16)27-23(29)22-18(24)8-5-9-19(22)25;1-29-18(9-16(28-29)12-5-2-3-6-13(12)22)17-10-26-19(11-25-17)27-21(30)20-14(23)7-4-8-15(20)24;2*1-26-15(8-13(25-26)16-6-3-7-28-16)14-9-23-17(10-22-14)24-19(27)18-11(20)4-2-5-12(18)21;1-26-14(7-12(25-26)18-21-5-6-28-18)13-8-23-15(9-22-13)24-17(27)16-10(19)3-2-4-11(16)20/h2-14H,1H3,(H,26,27,29);2-11H,1H3,(H,26,27,30);2*2-10H,1H3,(H,23,24,27);2-9H,1H3,(H,23,24,27)
InChIKeyLBZODAHGMQBTHX-UHFFFAOYSA-N
XLogP20.83
TPSA363.75 Ų
H-Bond Donors5
H-Bond Acceptors27
Rotatable Bonds20
Heavy Atoms143
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001975.93
LogP ≤ 520.83
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1027

Analyze 2,6-difluoro-N-[5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-(1-methyl-4-phenylpyrrol-2-yl)-2-pyridinyl]benzamide;2,6-difluoro-N-[5-[1-methyl-3-(1,3-thiazol-2-yl)pyrazol-5-yl]pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)pyrazin-2-yl]benzamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2,6-difluoro-N-[5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-(1-methyl-4-phenylpyrrol-2-yl)-2-pyridinyl]benzamide;2,6-difluoro-N-[5-[1-methyl-3-(1,3-thiazol-2-yl)pyrazol-5-yl]pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)pyrazin-2-yl]benzamide?
The IUPAC name of 2,6-difluoro-N-[5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-(1-methyl-4-phenylpyrrol-2-yl)-2-pyridinyl]benzamide;2,6-difluoro-N-[5-[1-methyl-3-(1,3-thiazol-2-yl)pyrazol-5-yl]pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)pyrazin-2-yl]benzamide (CID 159306591) is 2,6-difluoro-N-[5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-(1-methyl-4-phenylpyrrol-2-yl)-2-pyridinyl]benzamide;2,6-difluoro-N-[5-[1-methyl-3-(1,3-thiazol-2-yl)pyrazol-5-yl]pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)pyrazin-2-yl]benzamide.
What is the SMILES notation for 2,6-difluoro-N-[5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-(1-methyl-4-phenylpyrrol-2-yl)-2-pyridinyl]benzamide;2,6-difluoro-N-[5-[1-methyl-3-(1,3-thiazol-2-yl)pyrazol-5-yl]pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)pyrazin-2-yl]benzamide?
The canonical SMILES for 2,6-difluoro-N-[5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-(1-methyl-4-phenylpyrrol-2-yl)-2-pyridinyl]benzamide;2,6-difluoro-N-[5-[1-methyl-3-(1,3-thiazol-2-yl)pyrazol-5-yl]pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)pyrazin-2-yl]benzamide is Cn1cc(-c2ccccc2)cc1-c1ccc(NC(=O)c2c(F)cccc2F)nc1.Cn1nc(-c2ccccc2F)cc1-c1cnc(NC(=O)c2c(F)cccc2F)cn1.Cn1nc(-c2ccco2)cc1-c1cnc(NC(=O)c2c(F)cccc2F)cn1.Cn1nc(-c2cccs2)cc1-c1cnc(NC(=O)c2c(F)cccc2F)cn1.Cn1nc(-c2nccs2)cc1-c1cnc(NC(=O)c2c(F)cccc2F)cn1.
What is the InChIKey of 2,6-difluoro-N-[5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-(1-methyl-4-phenylpyrrol-2-yl)-2-pyridinyl]benzamide;2,6-difluoro-N-[5-[1-methyl-3-(1,3-thiazol-2-yl)pyrazol-5-yl]pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)pyrazin-2-yl]benzamide?
The InChIKey is LBZODAHGMQBTHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H17F2N3O.C21H14F3N5O.C19H13F2N5O2.C19H13F2N5OS.C18H12F2N6OS/c1-28-14-17(15-6-3-2-4-7-15)12-20(28)16-10-11-21(26-13-16)27-23(29)22-18(24)8-5-9-19(22)25;1-29-18(9-16(28-29)12-5-2-3-6-13(12)22)17-10-26-19(11-25-17)27-21(30)20-14(23)7-4-8-15(20)24;2*1-26-15(8-13(25-26)16-6-3-7-28-16)14-9-23-17(10-22-14)24-19(27)18-11(20)4-2-5-12(18)21;1-26-14(7-12(25-26)18-21-5-6-28-18)13-8-23-15(9-22-13)24-17(27)16-10(19)3-2-4-11(16)20/h2-14H,1H3,(H,26,27,29);2-11H,1H3,(H,26,27,30);2*2-10H,1H3,(H,23,24,27);2-9H,1H3,(H,23,24,27).
What are the key properties of 2,6-difluoro-N-[5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-(1-methyl-4-phenylpyrrol-2-yl)-2-pyridinyl]benzamide;2,6-difluoro-N-[5-[1-methyl-3-(1,3-thiazol-2-yl)pyrazol-5-yl]pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)pyrazin-2-yl]benzamide?
2,6-difluoro-N-[5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-(1-methyl-4-phenylpyrrol-2-yl)-2-pyridinyl]benzamide;2,6-difluoro-N-[5-[1-methyl-3-(1,3-thiazol-2-yl)pyrazol-5-yl]pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)pyrazin-2-yl]benzamide has a molecular weight of 1975.93 g/mol, XLogP of 20.83, 20 rotatable bonds, 5 hydrogen bond donors, and 27 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-difluoro-N-[5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-(1-methyl-4-phenylpyrrol-2-yl)-2-pyridinyl]benzamide;2,6-difluoro-N-[5-[1-methyl-3-(1,3-thiazol-2-yl)pyrazol-5-yl]pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)pyrazin-2-yl]benzamide is sourced from PubChem (CID 159306591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).