N-(4-fluoro-2-methoxyphenyl)-6-(trifluoromethyl)pyridine-3-carboxamide

C14H10F4N2O2 — CID 86926666

IUPACN-(4-fluoro-2-methoxyphenyl)-6-(trifluoromethyl)pyridine-3-carboxamide
SMILESCOc1cc(F)ccc1NC(=O)c1ccc(C(F)(F)F)nc1
InChIInChI=1S/C14H10F4N2O2/c1-22-11-6-9(15)3-4-10(11)20-13(21)8-2-5-12(19-7-8)14(16,17)18/h2-7H,1H3,(H,20,21)
InChIKeyHYZOTORUVWAGAW-UHFFFAOYSA-N
MW314.24 g/mol
LogP3.50
Rot. Bonds3

About N-(4-fluoro-2-methoxyphenyl)-6-(trifluoromethyl)pyridine-3-carboxamide

N-(4-fluoro-2-methoxyphenyl)-6-(trifluoromethyl)pyridine-3-carboxamide (PubChem CID 86926666) has the molecular formula C14H10F4N2O2 and a molecular weight of 314.24 g/mol. Its IUPAC name is N-(4-fluoro-2-methoxyphenyl)-6-(trifluoromethyl)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(4-fluoro-2-methoxyphenyl)-6-(trifluoromethyl)pyridine-3-carboxamide
PubChem CID86926666
Molecular FormulaC14H10F4N2O2
Molecular Weight314.24 g/mol
Exact Mass314.07
IUPAC NameN-(4-fluoro-2-methoxyphenyl)-6-(trifluoromethyl)pyridine-3-carboxamide
SMILESCOc1cc(F)ccc1NC(=O)c1ccc(C(F)(F)F)nc1
InChIInChI=1S/C14H10F4N2O2/c1-22-11-6-9(15)3-4-10(11)20-13(21)8-2-5-12(19-7-8)14(16,17)18/h2-7H,1H3,(H,20,21)
InChIKeyHYZOTORUVWAGAW-UHFFFAOYSA-N
XLogP3.50
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.24
LogP ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,4-difluorophenyl)-6-(trifluoromethyl)pyridine-3-carboxamide
CID 33164256
N-(4-fluoro-2-methoxyphenyl)-4-methylsulfonylbenzamide
CID 32608747
N-(2-ethoxy-4-fluorophenyl)-6-(2,2,2-trifluoroethoxy)pyridine-3-carboxamide
CID 87006231
4-bromo-N-(4-fluoro-2-methoxyphenyl)-3,5-dimethoxybenzamide
CID 32610623
N-(4-fluoro-2-methoxyphenyl)-4-sulfanylbenzamide
CID 107025880
5-chloro-N-(4-fluoro-2-methoxyphenyl)-6-(methylamino)pyridine-3-carboxamide
CID 62175694
N-(3-fluorophenyl)-6-(trifluoromethyl)pyridine-3-carboxamide
CID 24685793
2,2,2-trifluoro-N-(4-fluoro-2-methoxyphenyl)acetamide
CID 62492319
4-(cyclopropylsulfamoyl)-N-(4-fluoro-2-methoxyphenyl)benzamide
CID 32611210
4-amino-3,5-difluoro-N-(4-fluoro-2-methoxyphenyl)benzamide
CID 63185657
4-bromo-N-(4-fluoro-2-methoxyphenyl)-3-methylbenzamide
CID 115769609
5-amino-N-(4-fluoro-2-methoxyphenyl)pyridine-2-carboxamide
CID 81317431

Frequently Asked Questions

What is the IUPAC name of N-(4-fluoro-2-methoxyphenyl)-6-(trifluoromethyl)pyridine-3-carboxamide?
The IUPAC name of N-(4-fluoro-2-methoxyphenyl)-6-(trifluoromethyl)pyridine-3-carboxamide (CID 86926666) is N-(4-fluoro-2-methoxyphenyl)-6-(trifluoromethyl)pyridine-3-carboxamide.
What is the SMILES notation for N-(4-fluoro-2-methoxyphenyl)-6-(trifluoromethyl)pyridine-3-carboxamide?
The canonical SMILES for N-(4-fluoro-2-methoxyphenyl)-6-(trifluoromethyl)pyridine-3-carboxamide is COc1cc(F)ccc1NC(=O)c1ccc(C(F)(F)F)nc1.
What is the InChIKey of N-(4-fluoro-2-methoxyphenyl)-6-(trifluoromethyl)pyridine-3-carboxamide?
The InChIKey is HYZOTORUVWAGAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10F4N2O2/c1-22-11-6-9(15)3-4-10(11)20-13(21)8-2-5-12(19-7-8)14(16,17)18/h2-7H,1H3,(H,20,21).
What are the key properties of N-(4-fluoro-2-methoxyphenyl)-6-(trifluoromethyl)pyridine-3-carboxamide?
N-(4-fluoro-2-methoxyphenyl)-6-(trifluoromethyl)pyridine-3-carboxamide has a molecular weight of 314.24 g/mol, XLogP of 3.50, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluoro-2-methoxyphenyl)-6-(trifluoromethyl)pyridine-3-carboxamide is sourced from PubChem (CID 86926666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).