3-(2,6-dichlorophenyl)-2,4-difluoropyridine

C11H5Cl2F2N — CID 133090559

IUPAC3-(2,6-dichlorophenyl)-2,4-difluoropyridine
SMILESFc1ccnc(F)c1-c1c(Cl)cccc1Cl
InChIInChI=1S/C11H5Cl2F2N/c12-6-2-1-3-7(13)9(6)10-8(14)4-5-16-11(10)15/h1-5H
InChIKeyCPYWOLLCDGBELR-UHFFFAOYSA-N
MW260.07 g/mol
LogP4.33
Rot. Bonds1

About 3-(2,6-dichlorophenyl)-2,4-difluoropyridine

3-(2,6-dichlorophenyl)-2,4-difluoropyridine (PubChem CID 133090559) has the molecular formula C11H5Cl2F2N and a molecular weight of 260.07 g/mol. Its IUPAC name is 3-(2,6-dichlorophenyl)-2,4-difluoropyridine.

Molecular Properties

Compound Name3-(2,6-dichlorophenyl)-2,4-difluoropyridine
PubChem CID133090559
Molecular FormulaC11H5Cl2F2N
Molecular Weight260.07 g/mol
Exact Mass258.98
IUPAC Name3-(2,6-dichlorophenyl)-2,4-difluoropyridine
SMILESFc1ccnc(F)c1-c1c(Cl)cccc1Cl
InChIInChI=1S/C11H5Cl2F2N/c12-6-2-1-3-7(13)9(6)10-8(14)4-5-16-11(10)15/h1-5H
InChIKeyCPYWOLLCDGBELR-UHFFFAOYSA-N
XLogP4.33
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.07
LogP ≤ 54.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

3-(2-chloro-6-fluorophenyl)pyrazin-2-amine
CID 112559171
3-(2,6-dichlorophenyl)-4-fluoropyridine
CID 133090486
2-(2-chloro-6-fluorophenyl)-1-methylimidazole
CID 82077992
4-(2,3-dichlorophenyl)-2-fluoropyridin-3-ol
CID 118852451
5-(2-chloro-6-fluorophenyl)-1H-pyrazole
CID 130570620
1-chloro-3-fluoro-2-methylbenzene;2,4-dichloro-3-methylpyridine
CID 160532527
3-chloro-4-(2,6-dichlorophenyl)-2,5,6-trifluoropyridine
CID 133090476
[3-(2-chloro-6-fluorophenyl)pyrazin-2-yl]hydrazine
CID 112559501
4-(2,6-dichlorophenyl)-3-fluoropyridine
CID 133090517
4-chloro-2-(2,6-difluorophenyl)pyridine
CID 102825119
2,4,6-tris(2,6-dichlorophenyl)-3,5-difluoropyridine
CID 133090494
1-chloro-3-fluoro-2-(4-fluorophenyl)benzene
CID 57094846

Frequently Asked Questions

What is the IUPAC name of 3-(2,6-dichlorophenyl)-2,4-difluoropyridine?
The IUPAC name of 3-(2,6-dichlorophenyl)-2,4-difluoropyridine (CID 133090559) is 3-(2,6-dichlorophenyl)-2,4-difluoropyridine.
What is the SMILES notation for 3-(2,6-dichlorophenyl)-2,4-difluoropyridine?
The canonical SMILES for 3-(2,6-dichlorophenyl)-2,4-difluoropyridine is Fc1ccnc(F)c1-c1c(Cl)cccc1Cl.
What is the InChIKey of 3-(2,6-dichlorophenyl)-2,4-difluoropyridine?
The InChIKey is CPYWOLLCDGBELR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H5Cl2F2N/c12-6-2-1-3-7(13)9(6)10-8(14)4-5-16-11(10)15/h1-5H.
What are the key properties of 3-(2,6-dichlorophenyl)-2,4-difluoropyridine?
3-(2,6-dichlorophenyl)-2,4-difluoropyridine has a molecular weight of 260.07 g/mol, XLogP of 4.33, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,6-dichlorophenyl)-2,4-difluoropyridine is sourced from PubChem (CID 133090559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).