3-(4-fluorophenoxy)-5-(trifluoromethyl)pyridine-2-carboxamide

C13H8F4N2O2 — CID 1478735

IUPAC3-(4-fluorophenoxy)-5-(trifluoromethyl)pyridine-2-carboxamide
SMILESNC(=O)c1ncc(C(F)(F)F)cc1Oc1ccc(F)cc1
InChIInChI=1S/C13H8F4N2O2/c14-8-1-3-9(4-2-8)21-10-5-7(13(15,16)17)6-19-11(10)12(18)20/h1-6H,(H2,18,20)
InChIKeyAHQXSABAUNREIH-UHFFFAOYSA-N
MW300.21 g/mol
LogP3.13
Rot. Bonds3

About 3-(4-fluorophenoxy)-5-(trifluoromethyl)pyridine-2-carboxamide

3-(4-fluorophenoxy)-5-(trifluoromethyl)pyridine-2-carboxamide (PubChem CID 1478735) has the molecular formula C13H8F4N2O2 and a molecular weight of 300.21 g/mol. Its IUPAC name is 3-(4-fluorophenoxy)-5-(trifluoromethyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name3-(4-fluorophenoxy)-5-(trifluoromethyl)pyridine-2-carboxamide
PubChem CID1478735
Molecular FormulaC13H8F4N2O2
Molecular Weight300.21 g/mol
Exact Mass300.05
IUPAC Name3-(4-fluorophenoxy)-5-(trifluoromethyl)pyridine-2-carboxamide
SMILESNC(=O)c1ncc(C(F)(F)F)cc1Oc1ccc(F)cc1
InChIInChI=1S/C13H8F4N2O2/c14-8-1-3-9(4-2-8)21-10-5-7(13(15,16)17)6-19-11(10)12(18)20/h1-6H,(H2,18,20)
InChIKeyAHQXSABAUNREIH-UHFFFAOYSA-N
XLogP3.13
TPSA65.21 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.21
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-(4-fluorophenoxy)-5-(trifluoromethyl)pyridine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-(3,5-dichlorophenoxy)-5-(trifluoromethyl)pyridine-2-carboxamide
CID 3780229
3-fluoro-5-(trifluoromethyl)pyridine-2-carboxamide
CID 66545196
3-(4-fluorophenoxy)-5-(trifluoromethyl)pyridine-2-carbonitrile
CID 1478730
5-tert-butyl-3-[2-methoxy-4-(trifluoromethoxy)phenoxy]pyridine-2-carboxamide
CID 154645452
3-fluoro-5-(trifluoromethyl)pyridine-2-carboxamide;formic acid
CID 67467045
2-(4-fluoro-2-methylphenoxy)-5-(trifluoromethyl)pyridine-3-carboxamide
CID 175967839
3-[2-methoxy-4-(trifluoromethoxy)phenoxy]-5-(trifluoromethyl)pyridine-2-carbonyl chloride
CID 137406655
2-[4-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]acetamide
CID 173117551
3-[2-(trideuteriomethoxy)-4-(trifluoromethoxy)phenoxy]-5-(trifluoromethyl)pyridine-2-carboxylic acid
CID 154645359
methyl 3-methoxy-5-(trifluoromethyl)pyridine-2-carboxylate
CID 121231628
4-(4-fluorophenoxy)benzamide
CID 22142233
4-[[5-(trifluoromethyl)-2-pyridinyl]oxy]benzoic acid
CID 3730311

Frequently Asked Questions

What is the IUPAC name of 3-(4-fluorophenoxy)-5-(trifluoromethyl)pyridine-2-carboxamide?
The IUPAC name of 3-(4-fluorophenoxy)-5-(trifluoromethyl)pyridine-2-carboxamide (CID 1478735) is 3-(4-fluorophenoxy)-5-(trifluoromethyl)pyridine-2-carboxamide.
What is the SMILES notation for 3-(4-fluorophenoxy)-5-(trifluoromethyl)pyridine-2-carboxamide?
The canonical SMILES for 3-(4-fluorophenoxy)-5-(trifluoromethyl)pyridine-2-carboxamide is NC(=O)c1ncc(C(F)(F)F)cc1Oc1ccc(F)cc1.
What is the InChIKey of 3-(4-fluorophenoxy)-5-(trifluoromethyl)pyridine-2-carboxamide?
The InChIKey is AHQXSABAUNREIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8F4N2O2/c14-8-1-3-9(4-2-8)21-10-5-7(13(15,16)17)6-19-11(10)12(18)20/h1-6H,(H2,18,20).
What are the key properties of 3-(4-fluorophenoxy)-5-(trifluoromethyl)pyridine-2-carboxamide?
3-(4-fluorophenoxy)-5-(trifluoromethyl)pyridine-2-carboxamide has a molecular weight of 300.21 g/mol, XLogP of 3.13, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-fluorophenoxy)-5-(trifluoromethyl)pyridine-2-carboxamide is sourced from PubChem (CID 1478735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).