2,6-difluoro-N-[4-[[5-fluoro-3-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]-3-methylbenzamide;2,6-difluoro-3-methyl-N-[4-[[2-methyl-5-(trifluoromethyl)-4-pyridinyl]oxy]phenyl]benzamide;2,6-difluoro-3-methyl-N-[4-[[5-methyl-2-(trifluoromethyl)-3-pyridinyl]oxy]phenyl]benzamide;2,6-difluoro-3-methyl-N-[4-[[4-(trifluoromethyl)-3-pyridinyl]oxy]phenyl]benzamide;2-fluoro-4,6-dimethyl-N-[4-[[2-methyl-5-(trifluoromethyl)-4-pyridinyl]oxy]phenyl]benzamide;2-fluoro-4,6-dimethyl-N-[4-[[5-methyl-3-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]benzamide

C126H91F29N12O12 — CID 161029123

IUPAC2,6-difluoro-N-[4-[[5-fluoro-3-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]-3-methylbenzamide;2,6-difluoro-3-methyl-N-[4-[[2-methyl-5-(trifluoromethyl)-4-pyridinyl]oxy]phenyl]benzamide;2,6-difluoro-3-methyl-N-[4-[[5-methyl-2-(trifluoromethyl)-3-pyridinyl]oxy]phenyl]benzamide;2,6-difluoro-3-methyl-N-[4-[[4-(trifluoromethyl)-3-pyridinyl]oxy]phenyl]benzamide;2-fluoro-4,6-dimethyl-N-[4-[[2-methyl-5-(trifluoromethyl)-4-pyridinyl]oxy]phenyl]benzamide;2-fluoro-4,6-dimethyl-N-[4-[[5-methyl-3-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]benzamide
SMILESCc1cc(C)c(C(=O)Nc2ccc(Oc3cc(C)ncc3C(F)(F)F)cc2)c(F)c1.Cc1cc(C)c(C(=O)Nc2ccc(Oc3ncc(C)cc3C(F)(F)F)cc2)c(F)c1.Cc1cc(Oc2ccc(NC(=O)c3c(F)ccc(C)c3F)cc2)c(C(F)(F)F)cn1.Cc1ccc(F)c(C(=O)Nc2ccc(Oc3cnccc3C(F)(F)F)cc2)c1F.Cc1ccc(F)c(C(=O)Nc2ccc(Oc3ncc(F)cc3C(F)(F)F)cc2)c1F.Cc1cnc(C(F)(F)F)c(Oc2ccc(NC(=O)c3c(F)ccc(C)c3F)cc2)c1
InChIInChI=1S/2C22H18F4N2O2.2C21H15F5N2O2.C20H12F6N2O2.C20H13F5N2O2/c1-12-8-14(3)19(18(23)10-12)20(29)28-15-4-6-16(7-5-15)30-21-17(22(24,25)26)9-13(2)11-27-21;1-12-8-13(2)20(18(23)9-12)21(29)28-15-4-6-16(7-5-15)30-19-10-14(3)27-11-17(19)22(24,25)26;1-11-9-16(19(27-10-11)21(24,25)26)30-14-6-4-13(5-7-14)28-20(29)17-15(22)8-3-12(2)18(17)23;1-11-3-8-16(22)18(19(11)23)20(29)28-13-4-6-14(7-5-13)30-17-9-12(2)27-10-15(17)21(24,25)26;1-10-2-7-15(22)16(17(10)23)18(29)28-12-3-5-13(6-4-12)30-19-14(20(24,25)26)8-11(21)9-27-19;1-11-2-7-15(21)17(18(11)22)19(28)27-12-3-5-13(6-4-12)29-16-10-26-9-8-14(16)20(23,24)25/h2*4-11H,1-3H3,(H,28,29);2*3-10H,1-2H3,(H,28,29);2-9H,1H3,(H,28,29);2-10H,1H3,(H,27,28)
InChIKeyTZJIATIXWILWEQ-UHFFFAOYSA-N
MW2516.13 g/mol
LogP36.10
Rot. Bonds24

About 2,6-difluoro-N-[4-[[5-fluoro-3-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]-3-methylbenzamide;2,6-difluoro-3-methyl-N-[4-[[2-methyl-5-(trifluoromethyl)-4-pyridinyl]oxy]phenyl]benzamide;2,6-difluoro-3-methyl-N-[4-[[5-methyl-2-(trifluoromethyl)-3-pyridinyl]oxy]phenyl]benzamide;2,6-difluoro-3-methyl-N-[4-[[4-(trifluoromethyl)-3-pyridinyl]oxy]phenyl]benzamide;2-fluoro-4,6-dimethyl-N-[4-[[2-methyl-5-(trifluoromethyl)-4-pyridinyl]oxy]phenyl]benzamide;2-fluoro-4,6-dimethyl-N-[4-[[5-methyl-3-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]benzamide

2,6-difluoro-N-[4-[[5-fluoro-3-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]-3-methylbenzamide;2,6-difluoro-3-methyl-N-[4-[[2-methyl-5-(trifluoromethyl)-4-pyridinyl]oxy]phenyl]benzamide;2,6-difluoro-3-methyl-N-[4-[[5-methyl-2-(trifluoromethyl)-3-pyridinyl]oxy]phenyl]benzamide;2,6-difluoro-3-methyl-N-[4-[[4-(trifluoromethyl)-3-pyridinyl]oxy]phenyl]benzamide;2-fluoro-4,6-dimethyl-N-[4-[[2-methyl-5-(trifluoromethyl)-4-pyridinyl]oxy]phenyl]benzamide;2-fluoro-4,6-dimethyl-N-[4-[[5-methyl-3-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]benzamide (PubChem CID 161029123) has the molecular formula C126H91F29N12O12 and a molecular weight of 2516.13 g/mol. Its IUPAC name is 2,6-difluoro-N-[4-[[5-fluoro-3-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]-3-methylbenzamide;2,6-difluoro-3-methyl-N-[4-[[2-methyl-5-(trifluoromethyl)-4-pyridinyl]oxy]phenyl]benzamide;2,6-difluoro-3-methyl-N-[4-[[5-methyl-2-(trifluoromethyl)-3-pyridinyl]oxy]phenyl]benzamide;2,6-difluoro-3-methyl-N-[4-[[4-(trifluoromethyl)-3-pyridinyl]oxy]phenyl]benzamide;2-fluoro-4,6-dimethyl-N-[4-[[2-methyl-5-(trifluoromethyl)-4-pyridinyl]oxy]phenyl]benzamide;2-fluoro-4,6-dimethyl-N-[4-[[5-methyl-3-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]benzamide.

Molecular Properties

Compound Name2,6-difluoro-N-[4-[[5-fluoro-3-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]-3-methylbenzamide;2,6-difluoro-3-methyl-N-[4-[[2-methyl-5-(trifluoromethyl)-4-pyridinyl]oxy]phenyl]benzamide;2,6-difluoro-3-methyl-N-[4-[[5-methyl-2-(trifluoromethyl)-3-pyridinyl]oxy]phenyl]benzamide;2,6-difluoro-3-methyl-N-[4-[[4-(trifluoromethyl)-3-pyridinyl]oxy]phenyl]benzamide;2-fluoro-4,6-dimethyl-N-[4-[[2-methyl-5-(trifluoromethyl)-4-pyridinyl]oxy]phenyl]benzamide;2-fluoro-4,6-dimethyl-N-[4-[[5-methyl-3-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]benzamide
PubChem CID161029123
Molecular FormulaC126H91F29N12O12
Molecular Weight2516.13 g/mol
Exact Mass2514.64
IUPAC Name2,6-difluoro-N-[4-[[5-fluoro-3-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]-3-methylbenzamide;2,6-difluoro-3-methyl-N-[4-[[2-methyl-5-(trifluoromethyl)-4-pyridinyl]oxy]phenyl]benzamide;2,6-difluoro-3-methyl-N-[4-[[5-methyl-2-(trifluoromethyl)-3-pyridinyl]oxy]phenyl]benzamide;2,6-difluoro-3-methyl-N-[4-[[4-(trifluoromethyl)-3-pyridinyl]oxy]phenyl]benzamide;2-fluoro-4,6-dimethyl-N-[4-[[2-methyl-5-(trifluoromethyl)-4-pyridinyl]oxy]phenyl]benzamide;2-fluoro-4,6-dimethyl-N-[4-[[5-methyl-3-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]benzamide
SMILESCc1cc(C)c(C(=O)Nc2ccc(Oc3cc(C)ncc3C(F)(F)F)cc2)c(F)c1.Cc1cc(C)c(C(=O)Nc2ccc(Oc3ncc(C)cc3C(F)(F)F)cc2)c(F)c1.Cc1cc(Oc2ccc(NC(=O)c3c(F)ccc(C)c3F)cc2)c(C(F)(F)F)cn1.Cc1ccc(F)c(C(=O)Nc2ccc(Oc3cnccc3C(F)(F)F)cc2)c1F.Cc1ccc(F)c(C(=O)Nc2ccc(Oc3ncc(F)cc3C(F)(F)F)cc2)c1F.Cc1cnc(C(F)(F)F)c(Oc2ccc(NC(=O)c3c(F)ccc(C)c3F)cc2)c1
InChIInChI=1S/2C22H18F4N2O2.2C21H15F5N2O2.C20H12F6N2O2.C20H13F5N2O2/c1-12-8-14(3)19(18(23)10-12)20(29)28-15-4-6-16(7-5-15)30-21-17(22(24,25)26)9-13(2)11-27-21;1-12-8-13(2)20(18(23)9-12)21(29)28-15-4-6-16(7-5-15)30-19-10-14(3)27-11-17(19)22(24,25)26;1-11-9-16(19(27-10-11)21(24,25)26)30-14-6-4-13(5-7-14)28-20(29)17-15(22)8-3-12(2)18(17)23;1-11-3-8-16(22)18(19(11)23)20(29)28-13-4-6-14(7-5-13)30-17-9-12(2)27-10-15(17)21(24,25)26;1-10-2-7-15(22)16(17(10)23)18(29)28-12-3-5-13(6-4-12)30-19-14(20(24,25)26)8-11(21)9-27-19;1-11-2-7-15(21)17(18(11)22)19(28)27-12-3-5-13(6-4-12)29-16-10-26-9-8-14(16)20(23,24)25/h2*4-11H,1-3H3,(H,28,29);2*3-10H,1-2H3,(H,28,29);2-9H,1H3,(H,28,29);2-10H,1H3,(H,27,28)
InChIKeyTZJIATIXWILWEQ-UHFFFAOYSA-N
XLogP36.10
TPSA307.32 Ų
H-Bond Donors6
H-Bond Acceptors18
Rotatable Bonds24
Heavy Atoms179
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002516.13
LogP ≤ 536.10
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1018

Analyze 2,6-difluoro-N-[4-[[5-fluoro-3-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]-3-methylbenzamide;2,6-difluoro-3-methyl-N-[4-[[2-methyl-5-(trifluoromethyl)-4-pyridinyl]oxy]phenyl]benzamide;2,6-difluoro-3-methyl-N-[4-[[5-methyl-2-(trifluoromethyl)-3-pyridinyl]oxy]phenyl]benzamide;2,6-difluoro-3-methyl-N-[4-[[4-(trifluoromethyl)-3-pyridinyl]oxy]phenyl]benzamide;2-fluoro-4,6-dimethyl-N-[4-[[2-methyl-5-(trifluoromethyl)-4-pyridinyl]oxy]phenyl]benzamide;2-fluoro-4,6-dimethyl-N-[4-[[5-methyl-3-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]benzamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2,6-difluoro-N-[4-[[5-fluoro-3-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]-3-methylbenzamide;2,6-difluoro-3-methyl-N-[4-[[2-methyl-5-(trifluoromethyl)-4-pyridinyl]oxy]phenyl]benzamide;2,6-difluoro-3-methyl-N-[4-[[5-methyl-2-(trifluoromethyl)-3-pyridinyl]oxy]phenyl]benzamide;2,6-difluoro-3-methyl-N-[4-[[4-(trifluoromethyl)-3-pyridinyl]oxy]phenyl]benzamide;2-fluoro-4,6-dimethyl-N-[4-[[2-methyl-5-(trifluoromethyl)-4-pyridinyl]oxy]phenyl]benzamide;2-fluoro-4,6-dimethyl-N-[4-[[5-methyl-3-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]benzamide?
The IUPAC name of 2,6-difluoro-N-[4-[[5-fluoro-3-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]-3-methylbenzamide;2,6-difluoro-3-methyl-N-[4-[[2-methyl-5-(trifluoromethyl)-4-pyridinyl]oxy]phenyl]benzamide;2,6-difluoro-3-methyl-N-[4-[[5-methyl-2-(trifluoromethyl)-3-pyridinyl]oxy]phenyl]benzamide;2,6-difluoro-3-methyl-N-[4-[[4-(trifluoromethyl)-3-pyridinyl]oxy]phenyl]benzamide;2-fluoro-4,6-dimethyl-N-[4-[[2-methyl-5-(trifluoromethyl)-4-pyridinyl]oxy]phenyl]benzamide;2-fluoro-4,6-dimethyl-N-[4-[[5-methyl-3-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]benzamide (CID 161029123) is 2,6-difluoro-N-[4-[[5-fluoro-3-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]-3-methylbenzamide;2,6-difluoro-3-methyl-N-[4-[[2-methyl-5-(trifluoromethyl)-4-pyridinyl]oxy]phenyl]benzamide;2,6-difluoro-3-methyl-N-[4-[[5-methyl-2-(trifluoromethyl)-3-pyridinyl]oxy]phenyl]benzamide;2,6-difluoro-3-methyl-N-[4-[[4-(trifluoromethyl)-3-pyridinyl]oxy]phenyl]benzamide;2-fluoro-4,6-dimethyl-N-[4-[[2-methyl-5-(trifluoromethyl)-4-pyridinyl]oxy]phenyl]benzamide;2-fluoro-4,6-dimethyl-N-[4-[[5-methyl-3-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]benzamide.
What is the SMILES notation for 2,6-difluoro-N-[4-[[5-fluoro-3-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]-3-methylbenzamide;2,6-difluoro-3-methyl-N-[4-[[2-methyl-5-(trifluoromethyl)-4-pyridinyl]oxy]phenyl]benzamide;2,6-difluoro-3-methyl-N-[4-[[5-methyl-2-(trifluoromethyl)-3-pyridinyl]oxy]phenyl]benzamide;2,6-difluoro-3-methyl-N-[4-[[4-(trifluoromethyl)-3-pyridinyl]oxy]phenyl]benzamide;2-fluoro-4,6-dimethyl-N-[4-[[2-methyl-5-(trifluoromethyl)-4-pyridinyl]oxy]phenyl]benzamide;2-fluoro-4,6-dimethyl-N-[4-[[5-methyl-3-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]benzamide?
The canonical SMILES for 2,6-difluoro-N-[4-[[5-fluoro-3-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]-3-methylbenzamide;2,6-difluoro-3-methyl-N-[4-[[2-methyl-5-(trifluoromethyl)-4-pyridinyl]oxy]phenyl]benzamide;2,6-difluoro-3-methyl-N-[4-[[5-methyl-2-(trifluoromethyl)-3-pyridinyl]oxy]phenyl]benzamide;2,6-difluoro-3-methyl-N-[4-[[4-(trifluoromethyl)-3-pyridinyl]oxy]phenyl]benzamide;2-fluoro-4,6-dimethyl-N-[4-[[2-methyl-5-(trifluoromethyl)-4-pyridinyl]oxy]phenyl]benzamide;2-fluoro-4,6-dimethyl-N-[4-[[5-methyl-3-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]benzamide is Cc1cc(C)c(C(=O)Nc2ccc(Oc3cc(C)ncc3C(F)(F)F)cc2)c(F)c1.Cc1cc(C)c(C(=O)Nc2ccc(Oc3ncc(C)cc3C(F)(F)F)cc2)c(F)c1.Cc1cc(Oc2ccc(NC(=O)c3c(F)ccc(C)c3F)cc2)c(C(F)(F)F)cn1.Cc1ccc(F)c(C(=O)Nc2ccc(Oc3cnccc3C(F)(F)F)cc2)c1F.Cc1ccc(F)c(C(=O)Nc2ccc(Oc3ncc(F)cc3C(F)(F)F)cc2)c1F.Cc1cnc(C(F)(F)F)c(Oc2ccc(NC(=O)c3c(F)ccc(C)c3F)cc2)c1.
What is the InChIKey of 2,6-difluoro-N-[4-[[5-fluoro-3-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]-3-methylbenzamide;2,6-difluoro-3-methyl-N-[4-[[2-methyl-5-(trifluoromethyl)-4-pyridinyl]oxy]phenyl]benzamide;2,6-difluoro-3-methyl-N-[4-[[5-methyl-2-(trifluoromethyl)-3-pyridinyl]oxy]phenyl]benzamide;2,6-difluoro-3-methyl-N-[4-[[4-(trifluoromethyl)-3-pyridinyl]oxy]phenyl]benzamide;2-fluoro-4,6-dimethyl-N-[4-[[2-methyl-5-(trifluoromethyl)-4-pyridinyl]oxy]phenyl]benzamide;2-fluoro-4,6-dimethyl-N-[4-[[5-methyl-3-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]benzamide?
The InChIKey is TZJIATIXWILWEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C22H18F4N2O2.2C21H15F5N2O2.C20H12F6N2O2.C20H13F5N2O2/c1-12-8-14(3)19(18(23)10-12)20(29)28-15-4-6-16(7-5-15)30-21-17(22(24,25)26)9-13(2)11-27-21;1-12-8-13(2)20(18(23)9-12)21(29)28-15-4-6-16(7-5-15)30-19-10-14(3)27-11-17(19)22(24,25)26;1-11-9-16(19(27-10-11)21(24,25)26)30-14-6-4-13(5-7-14)28-20(29)17-15(22)8-3-12(2)18(17)23;1-11-3-8-16(22)18(19(11)23)20(29)28-13-4-6-14(7-5-13)30-17-9-12(2)27-10-15(17)21(24,25)26;1-10-2-7-15(22)16(17(10)23)18(29)28-12-3-5-13(6-4-12)30-19-14(20(24,25)26)8-11(21)9-27-19;1-11-2-7-15(21)17(18(11)22)19(28)27-12-3-5-13(6-4-12)29-16-10-26-9-8-14(16)20(23,24)25/h2*4-11H,1-3H3,(H,28,29);2*3-10H,1-2H3,(H,28,29);2-9H,1H3,(H,28,29);2-10H,1H3,(H,27,28).
What are the key properties of 2,6-difluoro-N-[4-[[5-fluoro-3-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]-3-methylbenzamide;2,6-difluoro-3-methyl-N-[4-[[2-methyl-5-(trifluoromethyl)-4-pyridinyl]oxy]phenyl]benzamide;2,6-difluoro-3-methyl-N-[4-[[5-methyl-2-(trifluoromethyl)-3-pyridinyl]oxy]phenyl]benzamide;2,6-difluoro-3-methyl-N-[4-[[4-(trifluoromethyl)-3-pyridinyl]oxy]phenyl]benzamide;2-fluoro-4,6-dimethyl-N-[4-[[2-methyl-5-(trifluoromethyl)-4-pyridinyl]oxy]phenyl]benzamide;2-fluoro-4,6-dimethyl-N-[4-[[5-methyl-3-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]benzamide?
2,6-difluoro-N-[4-[[5-fluoro-3-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]-3-methylbenzamide;2,6-difluoro-3-methyl-N-[4-[[2-methyl-5-(trifluoromethyl)-4-pyridinyl]oxy]phenyl]benzamide;2,6-difluoro-3-methyl-N-[4-[[5-methyl-2-(trifluoromethyl)-3-pyridinyl]oxy]phenyl]benzamide;2,6-difluoro-3-methyl-N-[4-[[4-(trifluoromethyl)-3-pyridinyl]oxy]phenyl]benzamide;2-fluoro-4,6-dimethyl-N-[4-[[2-methyl-5-(trifluoromethyl)-4-pyridinyl]oxy]phenyl]benzamide;2-fluoro-4,6-dimethyl-N-[4-[[5-methyl-3-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]benzamide has a molecular weight of 2516.13 g/mol, XLogP of 36.10, 24 rotatable bonds, 6 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-difluoro-N-[4-[[5-fluoro-3-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]-3-methylbenzamide;2,6-difluoro-3-methyl-N-[4-[[2-methyl-5-(trifluoromethyl)-4-pyridinyl]oxy]phenyl]benzamide;2,6-difluoro-3-methyl-N-[4-[[5-methyl-2-(trifluoromethyl)-3-pyridinyl]oxy]phenyl]benzamide;2,6-difluoro-3-methyl-N-[4-[[4-(trifluoromethyl)-3-pyridinyl]oxy]phenyl]benzamide;2-fluoro-4,6-dimethyl-N-[4-[[2-methyl-5-(trifluoromethyl)-4-pyridinyl]oxy]phenyl]benzamide;2-fluoro-4,6-dimethyl-N-[4-[[5-methyl-3-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]benzamide is sourced from PubChem (CID 161029123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).