2,3-dichloro-5-(2,6-dichlorophenyl)pyridine

C11H5Cl4N — CID 118826487

IUPAC2,3-dichloro-5-(2,6-dichlorophenyl)pyridine
SMILESClc1cc(-c2c(Cl)cccc2Cl)cnc1Cl
InChIInChI=1S/C11H5Cl4N/c12-7-2-1-3-8(13)10(7)6-4-9(14)11(15)16-5-6/h1-5H
InChIKeyUSASOXRZPUECDW-UHFFFAOYSA-N
MW292.98 g/mol
LogP5.36
Rot. Bonds1

About 2,3-dichloro-5-(2,6-dichlorophenyl)pyridine

2,3-dichloro-5-(2,6-dichlorophenyl)pyridine (PubChem CID 118826487) has the molecular formula C11H5Cl4N and a molecular weight of 292.98 g/mol. Its IUPAC name is 2,3-dichloro-5-(2,6-dichlorophenyl)pyridine.

Molecular Properties

Compound Name2,3-dichloro-5-(2,6-dichlorophenyl)pyridine
PubChem CID118826487
Molecular FormulaC11H5Cl4N
Molecular Weight292.98 g/mol
Exact Mass290.92
IUPAC Name2,3-dichloro-5-(2,6-dichlorophenyl)pyridine
SMILESClc1cc(-c2c(Cl)cccc2Cl)cnc1Cl
InChIInChI=1S/C11H5Cl4N/c12-7-2-1-3-8(13)10(7)6-4-9(14)11(15)16-5-6/h1-5H
InChIKeyUSASOXRZPUECDW-UHFFFAOYSA-N
XLogP5.36
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500292.98
LogP ≤ 55.36
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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Frequently Asked Questions

What is the IUPAC name of 2,3-dichloro-5-(2,6-dichlorophenyl)pyridine?
The IUPAC name of 2,3-dichloro-5-(2,6-dichlorophenyl)pyridine (CID 118826487) is 2,3-dichloro-5-(2,6-dichlorophenyl)pyridine.
What is the SMILES notation for 2,3-dichloro-5-(2,6-dichlorophenyl)pyridine?
The canonical SMILES for 2,3-dichloro-5-(2,6-dichlorophenyl)pyridine is Clc1cc(-c2c(Cl)cccc2Cl)cnc1Cl.
What is the InChIKey of 2,3-dichloro-5-(2,6-dichlorophenyl)pyridine?
The InChIKey is USASOXRZPUECDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H5Cl4N/c12-7-2-1-3-8(13)10(7)6-4-9(14)11(15)16-5-6/h1-5H.
What are the key properties of 2,3-dichloro-5-(2,6-dichlorophenyl)pyridine?
2,3-dichloro-5-(2,6-dichlorophenyl)pyridine has a molecular weight of 292.98 g/mol, XLogP of 5.36, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dichloro-5-(2,6-dichlorophenyl)pyridine is sourced from PubChem (CID 118826487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).