2-chloro-6-(2-ethylphenoxy)-4-(trifluoromethyl)pyridine

C14H11ClF3NO — CID 102715226

IUPAC2-chloro-6-(2-ethylphenoxy)-4-(trifluoromethyl)pyridine
SMILESCCc1ccccc1Oc1cc(C(F)(F)F)cc(Cl)n1
InChIInChI=1S/C14H11ClF3NO/c1-2-9-5-3-4-6-11(9)20-13-8-10(14(16,17)18)7-12(15)19-13/h3-8H,2H2,1H3
InChIKeyDDIQESOJKGSDJZ-UHFFFAOYSA-N
MW301.70 g/mol
LogP5.11
Rot. Bonds3

About 2-chloro-6-(2-ethylphenoxy)-4-(trifluoromethyl)pyridine

2-chloro-6-(2-ethylphenoxy)-4-(trifluoromethyl)pyridine (PubChem CID 102715226) has the molecular formula C14H11ClF3NO and a molecular weight of 301.70 g/mol. Its IUPAC name is 2-chloro-6-(2-ethylphenoxy)-4-(trifluoromethyl)pyridine.

Molecular Properties

Compound Name2-chloro-6-(2-ethylphenoxy)-4-(trifluoromethyl)pyridine
PubChem CID102715226
Molecular FormulaC14H11ClF3NO
Molecular Weight301.70 g/mol
Exact Mass301.05
IUPAC Name2-chloro-6-(2-ethylphenoxy)-4-(trifluoromethyl)pyridine
SMILESCCc1ccccc1Oc1cc(C(F)(F)F)cc(Cl)n1
InChIInChI=1S/C14H11ClF3NO/c1-2-9-5-3-4-6-11(9)20-13-8-10(14(16,17)18)7-12(15)19-13/h3-8H,2H2,1H3
InChIKeyDDIQESOJKGSDJZ-UHFFFAOYSA-N
XLogP5.11
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500301.70
LogP ≤ 55.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

2-chloro-6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-4-(trifluoromethyl)pyridine
CID 103174626
2-chloro-6-(2-nitrophenoxy)-4-(trifluoromethyl)pyridine
CID 102715235
2-chloro-6-(2-ethylphenoxy)pyridine
CID 60726953
4-(2-ethylphenoxy)-N-methyl-6-(trifluoromethyl)pyrimidin-2-amine
CID 114566390
2-chloro-6-(3-ethoxyphenoxy)-4-(trifluoromethyl)pyridine
CID 102715253
[4-(2-ethylphenoxy)-6-(trifluoromethyl)pyrimidin-2-yl]hydrazine
CID 114567761
2-chloro-6-(2-methoxy-4-methylphenoxy)-4-(trifluoromethyl)pyridine
CID 102715215
3-(2-ethylphenoxy)-5-(trifluoromethyl)aniline
CID 82995697
2-chloro-6-(3-fluorophenoxy)-4-(trifluoromethyl)pyridine
CID 102715210
6-(2-ethylphenoxy)-N,2-dimethylpyrimidin-4-amine
CID 80874565
4-chloro-6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-2-(trifluoromethyl)pyrimidine
CID 106766872
3,6-dichloro-5-(2-ethylphenoxy)-1,2,4-triazine
CID 81036264

Frequently Asked Questions

What is the IUPAC name of 2-chloro-6-(2-ethylphenoxy)-4-(trifluoromethyl)pyridine?
The IUPAC name of 2-chloro-6-(2-ethylphenoxy)-4-(trifluoromethyl)pyridine (CID 102715226) is 2-chloro-6-(2-ethylphenoxy)-4-(trifluoromethyl)pyridine.
What is the SMILES notation for 2-chloro-6-(2-ethylphenoxy)-4-(trifluoromethyl)pyridine?
The canonical SMILES for 2-chloro-6-(2-ethylphenoxy)-4-(trifluoromethyl)pyridine is CCc1ccccc1Oc1cc(C(F)(F)F)cc(Cl)n1.
What is the InChIKey of 2-chloro-6-(2-ethylphenoxy)-4-(trifluoromethyl)pyridine?
The InChIKey is DDIQESOJKGSDJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11ClF3NO/c1-2-9-5-3-4-6-11(9)20-13-8-10(14(16,17)18)7-12(15)19-13/h3-8H,2H2,1H3.
What are the key properties of 2-chloro-6-(2-ethylphenoxy)-4-(trifluoromethyl)pyridine?
2-chloro-6-(2-ethylphenoxy)-4-(trifluoromethyl)pyridine has a molecular weight of 301.70 g/mol, XLogP of 5.11, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-6-(2-ethylphenoxy)-4-(trifluoromethyl)pyridine is sourced from PubChem (CID 102715226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).