bis(2,6-difluoro-N-[2-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]benzamide);N-[3,5-difluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-2,6-difluorobenzamide;2-fluoro-N-[2-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]benzamide;2-fluoro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]benzamide;3-fluoro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]benzamide

C108H68F34N18O6 — CID 159581939

About bis(2,6-difluoro-N-[2-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]benzamide);N-[3,5-difluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-2,6-difluorobenzamide;2-fluoro-N-[2-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]benzamide;2-fluoro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]benzamide;3-fluoro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]benzamide

bis(2,6-difluoro-N-[2-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]benzamide);N-[3,5-difluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-2,6-difluorobenzamide;2-fluoro-N-[2-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]benzamide;2-fluoro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]benzamide;3-fluoro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]benzamide (PubChem CID 159581939) has the molecular formula C108H68F34N18O6 and a molecular weight of 2359.78 g/mol. Its IUPAC name is bis(2,6-difluoro-N-[2-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]benzamide);N-[3,5-difluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-2,6-difluorobenzamide;2-fluoro-N-[2-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]benzamide;2-fluoro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]benzamide;3-fluoro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]benzamide.

Molecular Properties

• Compound Name: bis(2,6-difluoro-N-[2-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]benzamide);N-[3,5-difluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-2,6-difluorobenzamide;2-fluoro-N-[2-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]benzamide;2-fluoro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]benzamide;3-fluoro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]benzamide
• PubChem CID: 159581939
• Molecular Formula: C108H68F34N18O6
• Molecular Weight: 2359.78 g/mol
• Exact Mass: 2358.50
• IUPAC Name: bis(2,6-difluoro-N-[2-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]benzamide);N-[3,5-difluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-2,6-difluorobenzamide;2-fluoro-N-[2-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]benzamide;2-fluoro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]benzamide;3-fluoro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]benzamide
• SMILES: Cn1nc(C(F)(F)F)cc1-c1c(F)cc(NC(=O)c2c(F)cccc2F)cc1F.Cn1nc(C(F)(F)F)cc1-c1ccc(NC(=O)c2c(F)cccc2F)c(F)c1.Cn1nc(C(F)(F)F)cc1-c1ccc(NC(=O)c2c(F)cccc2F)c(F)c1.Cn1nc(C(F)(F)F)cc1-c1ccc(NC(=O)c2cccc(F)c2)cc1F.Cn1nc(C(F)(F)F)cc1-c1ccc(NC(=O)c2ccccc2F)c(F)c1.Cn1nc(C(F)(F)F)cc1-c1ccc(NC(=O)c2ccccc2F)cc1F
• InChI: InChI=1S/C18H10F7N3O.2C18H11F6N3O.3C18H12F5N3O/c1-28-13(7-14(27-28)18(23,24)25)15-11(21)5-8(6-12(15)22)26-17(29)16-9(19)3-2-4-10(16)20;2*1-27-14(8-15(26-27)18(22,23)24)9-5-6-13(12(21)7-9)25-17(28)16-10(19)3-2-4-11(16)20;1-26-15(9-16(25-26)18(21,22)23)13-6-5-12(8-14(13)20)24-17(27)10-3-2-4-11(19)7-10;1-26-15(9-16(25-26)18(21,22)23)11-7-6-10(8-14(11)20)24-17(27)12-4-2-3-5-13(12)19;1-26-15(9-16(25-26)18(21,22)23)10-6-7-14(13(20)8-10)24-17(27)11-4-2-3-5-12(11)19/h2-7H,1H3,(H,26,29);2*2-8H,1H3,(H,25,28);3*2-9H,1H3,(H,24,27)
• InChIKey: MJCYKLJOCYMUGV-UHFFFAOYSA-N
• XLogP: 28.37
• TPSA: 281.52 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 18
• Rotatable Bonds: 18
• Heavy Atoms: 166
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2359.78
LogP ≤ 5	28.37
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	18

Frequently Asked Questions

What is the IUPAC name of bis(2,6-difluoro-N-[2-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]benzamide);N-[3,5-difluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-2,6-difluorobenzamide;2-fluoro-N-[2-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]benzamide;2-fluoro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]benzamide;3-fluoro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]benzamide?

The IUPAC name of bis(2,6-difluoro-N-[2-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]benzamide);N-[3,5-difluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-2,6-difluorobenzamide;2-fluoro-N-[2-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]benzamide;2-fluoro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]benzamide;3-fluoro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]benzamide (CID 159581939) is bis(2,6-difluoro-N-[2-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]benzamide);N-[3,5-difluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-2,6-difluorobenzamide;2-fluoro-N-[2-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]benzamide;2-fluoro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]benzamide;3-fluoro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]benzamide.

What is the SMILES notation for bis(2,6-difluoro-N-[2-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]benzamide);N-[3,5-difluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-2,6-difluorobenzamide;2-fluoro-N-[2-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]benzamide;2-fluoro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]benzamide;3-fluoro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]benzamide?

The canonical SMILES for bis(2,6-difluoro-N-[2-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]benzamide);N-[3,5-difluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-2,6-difluorobenzamide;2-fluoro-N-[2-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]benzamide;2-fluoro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]benzamide;3-fluoro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]benzamide is Cn1nc(C(F)(F)F)cc1-c1c(F)cc(NC(=O)c2c(F)cccc2F)cc1F.Cn1nc(C(F)(F)F)cc1-c1ccc(NC(=O)c2c(F)cccc2F)c(F)c1.Cn1nc(C(F)(F)F)cc1-c1ccc(NC(=O)c2c(F)cccc2F)c(F)c1.Cn1nc(C(F)(F)F)cc1-c1ccc(NC(=O)c2cccc(F)c2)cc1F.Cn1nc(C(F)(F)F)cc1-c1ccc(NC(=O)c2ccccc2F)c(F)c1.Cn1nc(C(F)(F)F)cc1-c1ccc(NC(=O)c2ccccc2F)cc1F.

What is the InChIKey of bis(2,6-difluoro-N-[2-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]benzamide);N-[3,5-difluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-2,6-difluorobenzamide;2-fluoro-N-[2-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]benzamide;2-fluoro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]benzamide;3-fluoro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]benzamide?

The InChIKey is MJCYKLJOCYMUGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H10F7N3O.2C18H11F6N3O.3C18H12F5N3O/c1-28-13(7-14(27-28)18(23,24)25)15-11(21)5-8(6-12(15)22)26-17(29)16-9(19)3-2-4-10(16)20;2*1-27-14(8-15(26-27)18(22,23)24)9-5-6-13(12(21)7-9)25-17(28)16-10(19)3-2-4-11(16)20;1-26-15(9-16(25-26)18(21,22)23)13-6-5-12(8-14(13)20)24-17(27)10-3-2-4-11(19)7-10;1-26-15(9-16(25-26)18(21,22)23)11-7-6-10(8-14(11)20)24-17(27)12-4-2-3-5-13(12)19;1-26-15(9-16(25-26)18(21,22)23)10-6-7-14(13(20)8-10)24-17(27)11-4-2-3-5-12(11)19/h2-7H,1H3,(H,26,29);2*2-8H,1H3,(H,25,28);3*2-9H,1H3,(H,24,27).

What are the key properties of bis(2,6-difluoro-N-[2-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]benzamide);N-[3,5-difluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-2,6-difluorobenzamide;2-fluoro-N-[2-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]benzamide;2-fluoro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]benzamide;3-fluoro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]benzamide?

bis(2,6-difluoro-N-[2-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]benzamide);N-[3,5-difluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-2,6-difluorobenzamide;2-fluoro-N-[2-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]benzamide;2-fluoro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]benzamide;3-fluoro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]benzamide has a molecular weight of 2359.78 g/mol, XLogP of 28.37, 18 rotatable bonds, 6 hydrogen bond donors, and 18 hydrogen bond acceptors.

Where does this data come from?

All data for bis(2,6-difluoro-N-[2-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]benzamide);N-[3,5-difluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-2,6-difluorobenzamide;2-fluoro-N-[2-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]benzamide;2-fluoro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]benzamide;3-fluoro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]benzamide is sourced from PubChem (CID 159581939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).