3-(3,5-dichlorophenoxy)-5-(trifluoromethyl)pyridine-2-carboxamide

C13H7Cl2F3N2O2 — CID 3780229

IUPAC3-(3,5-dichlorophenoxy)-5-(trifluoromethyl)pyridine-2-carboxamide
SMILESNC(=O)c1ncc(C(F)(F)F)cc1Oc1cc(Cl)cc(Cl)c1
InChIInChI=1S/C13H7Cl2F3N2O2/c14-7-2-8(15)4-9(3-7)22-10-1-6(13(16,17)18)5-20-11(10)12(19)21/h1-5H,(H2,19,21)
InChIKeyLZTNLGISCZBLKJ-UHFFFAOYSA-N
MW351.11 g/mol
LogP4.30
Rot. Bonds3

About 3-(3,5-dichlorophenoxy)-5-(trifluoromethyl)pyridine-2-carboxamide

3-(3,5-dichlorophenoxy)-5-(trifluoromethyl)pyridine-2-carboxamide (PubChem CID 3780229) has the molecular formula C13H7Cl2F3N2O2 and a molecular weight of 351.11 g/mol. Its IUPAC name is 3-(3,5-dichlorophenoxy)-5-(trifluoromethyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name3-(3,5-dichlorophenoxy)-5-(trifluoromethyl)pyridine-2-carboxamide
PubChem CID3780229
Molecular FormulaC13H7Cl2F3N2O2
Molecular Weight351.11 g/mol
Exact Mass349.98
IUPAC Name3-(3,5-dichlorophenoxy)-5-(trifluoromethyl)pyridine-2-carboxamide
SMILESNC(=O)c1ncc(C(F)(F)F)cc1Oc1cc(Cl)cc(Cl)c1
InChIInChI=1S/C13H7Cl2F3N2O2/c14-7-2-8(15)4-9(3-7)22-10-1-6(13(16,17)18)5-20-11(10)12(19)21/h1-5H,(H2,19,21)
InChIKeyLZTNLGISCZBLKJ-UHFFFAOYSA-N
XLogP4.30
TPSA65.21 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.11
LogP ≤ 54.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(4-fluorophenoxy)-5-(trifluoromethyl)pyridine-2-carboxamide
CID 1478735
3-fluoro-5-(trifluoromethyl)pyridine-2-carboxamide
CID 66545196
3-fluoro-5-(trifluoromethyl)pyridine-2-carboxamide;formic acid
CID 67467045
5-tert-butyl-3-[2-methoxy-4-(trifluoromethoxy)phenoxy]pyridine-2-carboxamide
CID 154645452
1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-2,2,2-trifluoroethanone
CID 137346954
3-[3-chloro-2-oxo-5-(trifluoromethyl)-1-pyridinyl]-5-(trifluoromethyl)pyridine-2-carboxamide
CID 103596180
methyl 3-methoxy-5-(trifluoromethyl)pyridine-2-carboxylate
CID 121231628
2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-2-oxoacetic acid
CID 139035182
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
methyl 3-bromo-5-(trifluoromethyl)pyridine-2-carboxylate
CID 46311089
3-[6-oxo-4-(trifluoromethyl)pyrimidin-1-yl]-5-(trifluoromethyl)pyridine-2-carboxamide
CID 103596184

Frequently Asked Questions

What is the IUPAC name of 3-(3,5-dichlorophenoxy)-5-(trifluoromethyl)pyridine-2-carboxamide?
The IUPAC name of 3-(3,5-dichlorophenoxy)-5-(trifluoromethyl)pyridine-2-carboxamide (CID 3780229) is 3-(3,5-dichlorophenoxy)-5-(trifluoromethyl)pyridine-2-carboxamide.
What is the SMILES notation for 3-(3,5-dichlorophenoxy)-5-(trifluoromethyl)pyridine-2-carboxamide?
The canonical SMILES for 3-(3,5-dichlorophenoxy)-5-(trifluoromethyl)pyridine-2-carboxamide is NC(=O)c1ncc(C(F)(F)F)cc1Oc1cc(Cl)cc(Cl)c1.
What is the InChIKey of 3-(3,5-dichlorophenoxy)-5-(trifluoromethyl)pyridine-2-carboxamide?
The InChIKey is LZTNLGISCZBLKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H7Cl2F3N2O2/c14-7-2-8(15)4-9(3-7)22-10-1-6(13(16,17)18)5-20-11(10)12(19)21/h1-5H,(H2,19,21).
What are the key properties of 3-(3,5-dichlorophenoxy)-5-(trifluoromethyl)pyridine-2-carboxamide?
3-(3,5-dichlorophenoxy)-5-(trifluoromethyl)pyridine-2-carboxamide has a molecular weight of 351.11 g/mol, XLogP of 4.30, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3,5-dichlorophenoxy)-5-(trifluoromethyl)pyridine-2-carboxamide is sourced from PubChem (CID 3780229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).