2,6-difluoro-N-[3-fluoro-4-[[3-(trifluoromethyl)-4-pyridinyl]methyl]phenyl]benzamide;2,6-difluoro-N-[3-fluoro-4-[[3-(trifluoromethyl)-4-pyridinyl]methyl]phenyl]-4-methylbenzamide;2,6-difluoro-N-[4-[[2-(trifluoromethyl)phenyl]methyl]phenyl]benzamide;2-fluoro-N-[3-fluoro-4-[[3-(trifluoromethyl)-4-pyridinyl]methyl]phenyl]benzamide;2-fluoro-N-[3-fluoro-4-[[3-(trifluoromethyl)-4-pyridinyl]methyl]phenyl]-6-methylbenzamide;2-fluoro-N-[4-[[2-(trifluoromethyl)phenyl]methyl]phenyl]benzamide

C124H83F31N10O6 — CID 158327767

IUPAC2,6-difluoro-N-[3-fluoro-4-[[3-(trifluoromethyl)-4-pyridinyl]methyl]phenyl]benzamide;2,6-difluoro-N-[3-fluoro-4-[[3-(trifluoromethyl)-4-pyridinyl]methyl]phenyl]-4-methylbenzamide;2,6-difluoro-N-[4-[[2-(trifluoromethyl)phenyl]methyl]phenyl]benzamide;2-fluoro-N-[3-fluoro-4-[[3-(trifluoromethyl)-4-pyridinyl]methyl]phenyl]benzamide;2-fluoro-N-[3-fluoro-4-[[3-(trifluoromethyl)-4-pyridinyl]methyl]phenyl]-6-methylbenzamide;2-fluoro-N-[4-[[2-(trifluoromethyl)phenyl]methyl]phenyl]benzamide
SMILESCc1cc(F)c(C(=O)Nc2ccc(Cc3ccncc3C(F)(F)F)c(F)c2)c(F)c1.Cc1cccc(F)c1C(=O)Nc1ccc(Cc2ccncc2C(F)(F)F)c(F)c1.O=C(Nc1ccc(Cc2ccccc2C(F)(F)F)cc1)c1c(F)cccc1F.O=C(Nc1ccc(Cc2ccccc2C(F)(F)F)cc1)c1ccccc1F.O=C(Nc1ccc(Cc2ccncc2C(F)(F)F)c(F)c1)c1c(F)cccc1F.O=C(Nc1ccc(Cc2ccncc2C(F)(F)F)c(F)c1)c1ccccc1F
InChIInChI=1S/C21H14F6N2O.C21H15F5N2O.C21H14F5NO.C21H15F4NO.C20H12F6N2O.C20H13F5N2O/c1-11-6-17(23)19(18(24)7-11)20(30)29-14-3-2-13(16(22)9-14)8-12-4-5-28-10-15(12)21(25,26)27;1-12-3-2-4-17(22)19(12)20(29)28-15-6-5-14(18(23)10-15)9-13-7-8-27-11-16(13)21(24,25)26;22-17-6-3-7-18(23)19(17)20(28)27-15-10-8-13(9-11-15)12-14-4-1-2-5-16(14)21(24,25)26;22-19-8-4-2-6-17(19)20(27)26-16-11-9-14(10-12-16)13-15-5-1-3-7-18(15)21(23,24)25;21-15-2-1-3-16(22)18(15)19(29)28-13-5-4-12(17(23)9-13)8-11-6-7-27-10-14(11)20(24,25)26;21-17-4-2-1-3-15(17)19(28)27-14-6-5-13(18(22)10-14)9-12-7-8-26-11-16(12)20(23,24)25/h2-7,9-10H,8H2,1H3,(H,29,30);2-8,10-11H,9H2,1H3,(H,28,29);1-11H,12H2,(H,27,28);1-12H,13H2,(H,26,27);1-7,9-10H,8H2,(H,28,29);1-8,10-11H,9H2,(H,27,28)
InChIKeyGPPUTVNWZHAEKT-UHFFFAOYSA-N
MW2398.03 g/mol
LogP33.30
Rot. Bonds24

About 2,6-difluoro-N-[3-fluoro-4-[[3-(trifluoromethyl)-4-pyridinyl]methyl]phenyl]benzamide;2,6-difluoro-N-[3-fluoro-4-[[3-(trifluoromethyl)-4-pyridinyl]methyl]phenyl]-4-methylbenzamide;2,6-difluoro-N-[4-[[2-(trifluoromethyl)phenyl]methyl]phenyl]benzamide;2-fluoro-N-[3-fluoro-4-[[3-(trifluoromethyl)-4-pyridinyl]methyl]phenyl]benzamide;2-fluoro-N-[3-fluoro-4-[[3-(trifluoromethyl)-4-pyridinyl]methyl]phenyl]-6-methylbenzamide;2-fluoro-N-[4-[[2-(trifluoromethyl)phenyl]methyl]phenyl]benzamide

2,6-difluoro-N-[3-fluoro-4-[[3-(trifluoromethyl)-4-pyridinyl]methyl]phenyl]benzamide;2,6-difluoro-N-[3-fluoro-4-[[3-(trifluoromethyl)-4-pyridinyl]methyl]phenyl]-4-methylbenzamide;2,6-difluoro-N-[4-[[2-(trifluoromethyl)phenyl]methyl]phenyl]benzamide;2-fluoro-N-[3-fluoro-4-[[3-(trifluoromethyl)-4-pyridinyl]methyl]phenyl]benzamide;2-fluoro-N-[3-fluoro-4-[[3-(trifluoromethyl)-4-pyridinyl]methyl]phenyl]-6-methylbenzamide;2-fluoro-N-[4-[[2-(trifluoromethyl)phenyl]methyl]phenyl]benzamide (PubChem CID 158327767) has the molecular formula C124H83F31N10O6 and a molecular weight of 2398.03 g/mol. Its IUPAC name is 2,6-difluoro-N-[3-fluoro-4-[[3-(trifluoromethyl)-4-pyridinyl]methyl]phenyl]benzamide;2,6-difluoro-N-[3-fluoro-4-[[3-(trifluoromethyl)-4-pyridinyl]methyl]phenyl]-4-methylbenzamide;2,6-difluoro-N-[4-[[2-(trifluoromethyl)phenyl]methyl]phenyl]benzamide;2-fluoro-N-[3-fluoro-4-[[3-(trifluoromethyl)-4-pyridinyl]methyl]phenyl]benzamide;2-fluoro-N-[3-fluoro-4-[[3-(trifluoromethyl)-4-pyridinyl]methyl]phenyl]-6-methylbenzamide;2-fluoro-N-[4-[[2-(trifluoromethyl)phenyl]methyl]phenyl]benzamide.

Molecular Properties

Compound Name2,6-difluoro-N-[3-fluoro-4-[[3-(trifluoromethyl)-4-pyridinyl]methyl]phenyl]benzamide;2,6-difluoro-N-[3-fluoro-4-[[3-(trifluoromethyl)-4-pyridinyl]methyl]phenyl]-4-methylbenzamide;2,6-difluoro-N-[4-[[2-(trifluoromethyl)phenyl]methyl]phenyl]benzamide;2-fluoro-N-[3-fluoro-4-[[3-(trifluoromethyl)-4-pyridinyl]methyl]phenyl]benzamide;2-fluoro-N-[3-fluoro-4-[[3-(trifluoromethyl)-4-pyridinyl]methyl]phenyl]-6-methylbenzamide;2-fluoro-N-[4-[[2-(trifluoromethyl)phenyl]methyl]phenyl]benzamide
PubChem CID158327767
Molecular FormulaC124H83F31N10O6
Molecular Weight2398.03 g/mol
Exact Mass2396.60
IUPAC Name2,6-difluoro-N-[3-fluoro-4-[[3-(trifluoromethyl)-4-pyridinyl]methyl]phenyl]benzamide;2,6-difluoro-N-[3-fluoro-4-[[3-(trifluoromethyl)-4-pyridinyl]methyl]phenyl]-4-methylbenzamide;2,6-difluoro-N-[4-[[2-(trifluoromethyl)phenyl]methyl]phenyl]benzamide;2-fluoro-N-[3-fluoro-4-[[3-(trifluoromethyl)-4-pyridinyl]methyl]phenyl]benzamide;2-fluoro-N-[3-fluoro-4-[[3-(trifluoromethyl)-4-pyridinyl]methyl]phenyl]-6-methylbenzamide;2-fluoro-N-[4-[[2-(trifluoromethyl)phenyl]methyl]phenyl]benzamide
SMILESCc1cc(F)c(C(=O)Nc2ccc(Cc3ccncc3C(F)(F)F)c(F)c2)c(F)c1.Cc1cccc(F)c1C(=O)Nc1ccc(Cc2ccncc2C(F)(F)F)c(F)c1.O=C(Nc1ccc(Cc2ccccc2C(F)(F)F)cc1)c1c(F)cccc1F.O=C(Nc1ccc(Cc2ccccc2C(F)(F)F)cc1)c1ccccc1F.O=C(Nc1ccc(Cc2ccncc2C(F)(F)F)c(F)c1)c1c(F)cccc1F.O=C(Nc1ccc(Cc2ccncc2C(F)(F)F)c(F)c1)c1ccccc1F
InChIInChI=1S/C21H14F6N2O.C21H15F5N2O.C21H14F5NO.C21H15F4NO.C20H12F6N2O.C20H13F5N2O/c1-11-6-17(23)19(18(24)7-11)20(30)29-14-3-2-13(16(22)9-14)8-12-4-5-28-10-15(12)21(25,26)27;1-12-3-2-4-17(22)19(12)20(29)28-15-6-5-14(18(23)10-15)9-13-7-8-27-11-16(13)21(24,25)26;22-17-6-3-7-18(23)19(17)20(28)27-15-10-8-13(9-11-15)12-14-4-1-2-5-16(14)21(24,25)26;22-19-8-4-2-6-17(19)20(27)26-16-11-9-14(10-12-16)13-15-5-1-3-7-18(15)21(23,24)25;21-15-2-1-3-16(22)18(15)19(29)28-13-5-4-12(17(23)9-13)8-11-6-7-27-10-14(11)20(24,25)26;21-17-4-2-1-3-15(17)19(28)27-14-6-5-13(18(22)10-14)9-12-7-8-26-11-16(12)20(23,24)25/h2-7,9-10H,8H2,1H3,(H,29,30);2-8,10-11H,9H2,1H3,(H,28,29);1-11H,12H2,(H,27,28);1-12H,13H2,(H,26,27);1-7,9-10H,8H2,(H,28,29);1-8,10-11H,9H2,(H,27,28)
InChIKeyGPPUTVNWZHAEKT-UHFFFAOYSA-N
XLogP33.30
TPSA226.16 Ų
H-Bond Donors6
H-Bond Acceptors10
Rotatable Bonds24
Heavy Atoms171
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002398.03
LogP ≤ 533.30
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1010

Analyze 2,6-difluoro-N-[3-fluoro-4-[[3-(trifluoromethyl)-4-pyridinyl]methyl]phenyl]benzamide;2,6-difluoro-N-[3-fluoro-4-[[3-(trifluoromethyl)-4-pyridinyl]methyl]phenyl]-4-methylbenzamide;2,6-difluoro-N-[4-[[2-(trifluoromethyl)phenyl]methyl]phenyl]benzamide;2-fluoro-N-[3-fluoro-4-[[3-(trifluoromethyl)-4-pyridinyl]methyl]phenyl]benzamide;2-fluoro-N-[3-fluoro-4-[[3-(trifluoromethyl)-4-pyridinyl]methyl]phenyl]-6-methylbenzamide;2-fluoro-N-[4-[[2-(trifluoromethyl)phenyl]methyl]phenyl]benzamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2,6-difluoro-N-[3-fluoro-4-[[3-(trifluoromethyl)-4-pyridinyl]methyl]phenyl]benzamide;2,6-difluoro-N-[3-fluoro-4-[[3-(trifluoromethyl)-4-pyridinyl]methyl]phenyl]-4-methylbenzamide;2,6-difluoro-N-[4-[[2-(trifluoromethyl)phenyl]methyl]phenyl]benzamide;2-fluoro-N-[3-fluoro-4-[[3-(trifluoromethyl)-4-pyridinyl]methyl]phenyl]benzamide;2-fluoro-N-[3-fluoro-4-[[3-(trifluoromethyl)-4-pyridinyl]methyl]phenyl]-6-methylbenzamide;2-fluoro-N-[4-[[2-(trifluoromethyl)phenyl]methyl]phenyl]benzamide?
The IUPAC name of 2,6-difluoro-N-[3-fluoro-4-[[3-(trifluoromethyl)-4-pyridinyl]methyl]phenyl]benzamide;2,6-difluoro-N-[3-fluoro-4-[[3-(trifluoromethyl)-4-pyridinyl]methyl]phenyl]-4-methylbenzamide;2,6-difluoro-N-[4-[[2-(trifluoromethyl)phenyl]methyl]phenyl]benzamide;2-fluoro-N-[3-fluoro-4-[[3-(trifluoromethyl)-4-pyridinyl]methyl]phenyl]benzamide;2-fluoro-N-[3-fluoro-4-[[3-(trifluoromethyl)-4-pyridinyl]methyl]phenyl]-6-methylbenzamide;2-fluoro-N-[4-[[2-(trifluoromethyl)phenyl]methyl]phenyl]benzamide (CID 158327767) is 2,6-difluoro-N-[3-fluoro-4-[[3-(trifluoromethyl)-4-pyridinyl]methyl]phenyl]benzamide;2,6-difluoro-N-[3-fluoro-4-[[3-(trifluoromethyl)-4-pyridinyl]methyl]phenyl]-4-methylbenzamide;2,6-difluoro-N-[4-[[2-(trifluoromethyl)phenyl]methyl]phenyl]benzamide;2-fluoro-N-[3-fluoro-4-[[3-(trifluoromethyl)-4-pyridinyl]methyl]phenyl]benzamide;2-fluoro-N-[3-fluoro-4-[[3-(trifluoromethyl)-4-pyridinyl]methyl]phenyl]-6-methylbenzamide;2-fluoro-N-[4-[[2-(trifluoromethyl)phenyl]methyl]phenyl]benzamide.
What is the SMILES notation for 2,6-difluoro-N-[3-fluoro-4-[[3-(trifluoromethyl)-4-pyridinyl]methyl]phenyl]benzamide;2,6-difluoro-N-[3-fluoro-4-[[3-(trifluoromethyl)-4-pyridinyl]methyl]phenyl]-4-methylbenzamide;2,6-difluoro-N-[4-[[2-(trifluoromethyl)phenyl]methyl]phenyl]benzamide;2-fluoro-N-[3-fluoro-4-[[3-(trifluoromethyl)-4-pyridinyl]methyl]phenyl]benzamide;2-fluoro-N-[3-fluoro-4-[[3-(trifluoromethyl)-4-pyridinyl]methyl]phenyl]-6-methylbenzamide;2-fluoro-N-[4-[[2-(trifluoromethyl)phenyl]methyl]phenyl]benzamide?
The canonical SMILES for 2,6-difluoro-N-[3-fluoro-4-[[3-(trifluoromethyl)-4-pyridinyl]methyl]phenyl]benzamide;2,6-difluoro-N-[3-fluoro-4-[[3-(trifluoromethyl)-4-pyridinyl]methyl]phenyl]-4-methylbenzamide;2,6-difluoro-N-[4-[[2-(trifluoromethyl)phenyl]methyl]phenyl]benzamide;2-fluoro-N-[3-fluoro-4-[[3-(trifluoromethyl)-4-pyridinyl]methyl]phenyl]benzamide;2-fluoro-N-[3-fluoro-4-[[3-(trifluoromethyl)-4-pyridinyl]methyl]phenyl]-6-methylbenzamide;2-fluoro-N-[4-[[2-(trifluoromethyl)phenyl]methyl]phenyl]benzamide is Cc1cc(F)c(C(=O)Nc2ccc(Cc3ccncc3C(F)(F)F)c(F)c2)c(F)c1.Cc1cccc(F)c1C(=O)Nc1ccc(Cc2ccncc2C(F)(F)F)c(F)c1.O=C(Nc1ccc(Cc2ccccc2C(F)(F)F)cc1)c1c(F)cccc1F.O=C(Nc1ccc(Cc2ccccc2C(F)(F)F)cc1)c1ccccc1F.O=C(Nc1ccc(Cc2ccncc2C(F)(F)F)c(F)c1)c1c(F)cccc1F.O=C(Nc1ccc(Cc2ccncc2C(F)(F)F)c(F)c1)c1ccccc1F.
What is the InChIKey of 2,6-difluoro-N-[3-fluoro-4-[[3-(trifluoromethyl)-4-pyridinyl]methyl]phenyl]benzamide;2,6-difluoro-N-[3-fluoro-4-[[3-(trifluoromethyl)-4-pyridinyl]methyl]phenyl]-4-methylbenzamide;2,6-difluoro-N-[4-[[2-(trifluoromethyl)phenyl]methyl]phenyl]benzamide;2-fluoro-N-[3-fluoro-4-[[3-(trifluoromethyl)-4-pyridinyl]methyl]phenyl]benzamide;2-fluoro-N-[3-fluoro-4-[[3-(trifluoromethyl)-4-pyridinyl]methyl]phenyl]-6-methylbenzamide;2-fluoro-N-[4-[[2-(trifluoromethyl)phenyl]methyl]phenyl]benzamide?
The InChIKey is GPPUTVNWZHAEKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H14F6N2O.C21H15F5N2O.C21H14F5NO.C21H15F4NO.C20H12F6N2O.C20H13F5N2O/c1-11-6-17(23)19(18(24)7-11)20(30)29-14-3-2-13(16(22)9-14)8-12-4-5-28-10-15(12)21(25,26)27;1-12-3-2-4-17(22)19(12)20(29)28-15-6-5-14(18(23)10-15)9-13-7-8-27-11-16(13)21(24,25)26;22-17-6-3-7-18(23)19(17)20(28)27-15-10-8-13(9-11-15)12-14-4-1-2-5-16(14)21(24,25)26;22-19-8-4-2-6-17(19)20(27)26-16-11-9-14(10-12-16)13-15-5-1-3-7-18(15)21(23,24)25;21-15-2-1-3-16(22)18(15)19(29)28-13-5-4-12(17(23)9-13)8-11-6-7-27-10-14(11)20(24,25)26;21-17-4-2-1-3-15(17)19(28)27-14-6-5-13(18(22)10-14)9-12-7-8-26-11-16(12)20(23,24)25/h2-7,9-10H,8H2,1H3,(H,29,30);2-8,10-11H,9H2,1H3,(H,28,29);1-11H,12H2,(H,27,28);1-12H,13H2,(H,26,27);1-7,9-10H,8H2,(H,28,29);1-8,10-11H,9H2,(H,27,28).
What are the key properties of 2,6-difluoro-N-[3-fluoro-4-[[3-(trifluoromethyl)-4-pyridinyl]methyl]phenyl]benzamide;2,6-difluoro-N-[3-fluoro-4-[[3-(trifluoromethyl)-4-pyridinyl]methyl]phenyl]-4-methylbenzamide;2,6-difluoro-N-[4-[[2-(trifluoromethyl)phenyl]methyl]phenyl]benzamide;2-fluoro-N-[3-fluoro-4-[[3-(trifluoromethyl)-4-pyridinyl]methyl]phenyl]benzamide;2-fluoro-N-[3-fluoro-4-[[3-(trifluoromethyl)-4-pyridinyl]methyl]phenyl]-6-methylbenzamide;2-fluoro-N-[4-[[2-(trifluoromethyl)phenyl]methyl]phenyl]benzamide?
2,6-difluoro-N-[3-fluoro-4-[[3-(trifluoromethyl)-4-pyridinyl]methyl]phenyl]benzamide;2,6-difluoro-N-[3-fluoro-4-[[3-(trifluoromethyl)-4-pyridinyl]methyl]phenyl]-4-methylbenzamide;2,6-difluoro-N-[4-[[2-(trifluoromethyl)phenyl]methyl]phenyl]benzamide;2-fluoro-N-[3-fluoro-4-[[3-(trifluoromethyl)-4-pyridinyl]methyl]phenyl]benzamide;2-fluoro-N-[3-fluoro-4-[[3-(trifluoromethyl)-4-pyridinyl]methyl]phenyl]-6-methylbenzamide;2-fluoro-N-[4-[[2-(trifluoromethyl)phenyl]methyl]phenyl]benzamide has a molecular weight of 2398.03 g/mol, XLogP of 33.30, 24 rotatable bonds, 6 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-difluoro-N-[3-fluoro-4-[[3-(trifluoromethyl)-4-pyridinyl]methyl]phenyl]benzamide;2,6-difluoro-N-[3-fluoro-4-[[3-(trifluoromethyl)-4-pyridinyl]methyl]phenyl]-4-methylbenzamide;2,6-difluoro-N-[4-[[2-(trifluoromethyl)phenyl]methyl]phenyl]benzamide;2-fluoro-N-[3-fluoro-4-[[3-(trifluoromethyl)-4-pyridinyl]methyl]phenyl]benzamide;2-fluoro-N-[3-fluoro-4-[[3-(trifluoromethyl)-4-pyridinyl]methyl]phenyl]-6-methylbenzamide;2-fluoro-N-[4-[[2-(trifluoromethyl)phenyl]methyl]phenyl]benzamide is sourced from PubChem (CID 158327767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).