2-(2,4-dichlorophenoxy)-5-(trifluoromethyl)pyridine

C12H6Cl2F3NO — CID 12877614

IUPAC2-(2,4-dichlorophenoxy)-5-(trifluoromethyl)pyridine
SMILESFC(F)(F)c1ccc(Oc2ccc(Cl)cc2Cl)nc1
InChIInChI=1S/C12H6Cl2F3NO/c13-8-2-3-10(9(14)5-8)19-11-4-1-7(6-18-11)12(15,16)17/h1-6H
InChIKeyDWUVKWPKIANOKG-UHFFFAOYSA-N
MW308.09 g/mol
LogP5.20
Rot. Bonds2

About 2-(2,4-dichlorophenoxy)-5-(trifluoromethyl)pyridine

2-(2,4-dichlorophenoxy)-5-(trifluoromethyl)pyridine (PubChem CID 12877614) has the molecular formula C12H6Cl2F3NO and a molecular weight of 308.09 g/mol. Its IUPAC name is 2-(2,4-dichlorophenoxy)-5-(trifluoromethyl)pyridine.

Molecular Properties

Compound Name2-(2,4-dichlorophenoxy)-5-(trifluoromethyl)pyridine
PubChem CID12877614
Molecular FormulaC12H6Cl2F3NO
Molecular Weight308.09 g/mol
Exact Mass306.98
IUPAC Name2-(2,4-dichlorophenoxy)-5-(trifluoromethyl)pyridine
SMILESFC(F)(F)c1ccc(Oc2ccc(Cl)cc2Cl)nc1
InChIInChI=1S/C12H6Cl2F3NO/c13-8-2-3-10(9(14)5-8)19-11-4-1-7(6-18-11)12(15,16)17/h1-6H
InChIKeyDWUVKWPKIANOKG-UHFFFAOYSA-N
XLogP5.20
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500308.09
LogP ≤ 55.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2-(2,4-dichlorophenoxy)-5-(trifluoromethyl)pyridine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dichlorophenoxy)-5-(trifluoromethyl)pyridine?
The IUPAC name of 2-(2,4-dichlorophenoxy)-5-(trifluoromethyl)pyridine (CID 12877614) is 2-(2,4-dichlorophenoxy)-5-(trifluoromethyl)pyridine.
What is the SMILES notation for 2-(2,4-dichlorophenoxy)-5-(trifluoromethyl)pyridine?
The canonical SMILES for 2-(2,4-dichlorophenoxy)-5-(trifluoromethyl)pyridine is FC(F)(F)c1ccc(Oc2ccc(Cl)cc2Cl)nc1.
What is the InChIKey of 2-(2,4-dichlorophenoxy)-5-(trifluoromethyl)pyridine?
The InChIKey is DWUVKWPKIANOKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H6Cl2F3NO/c13-8-2-3-10(9(14)5-8)19-11-4-1-7(6-18-11)12(15,16)17/h1-6H.
What are the key properties of 2-(2,4-dichlorophenoxy)-5-(trifluoromethyl)pyridine?
2-(2,4-dichlorophenoxy)-5-(trifluoromethyl)pyridine has a molecular weight of 308.09 g/mol, XLogP of 5.20, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dichlorophenoxy)-5-(trifluoromethyl)pyridine is sourced from PubChem (CID 12877614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).