5-chloro-2-(2,4-dichlorophenyl)-3-iodopyridine

C11H5Cl3IN — CID 133088212

IUPAC5-chloro-2-(2,4-dichlorophenyl)-3-iodopyridine
SMILESClc1ccc(-c2ncc(Cl)cc2I)c(Cl)c1
InChIInChI=1S/C11H5Cl3IN/c12-6-1-2-8(9(14)3-6)11-10(15)4-7(13)5-16-11/h1-5H
InChIKeyKZTFRZFLPSNTDK-UHFFFAOYSA-N
MW384.43 g/mol
LogP5.31
Rot. Bonds1

About 5-chloro-2-(2,4-dichlorophenyl)-3-iodopyridine

5-chloro-2-(2,4-dichlorophenyl)-3-iodopyridine (PubChem CID 133088212) has the molecular formula C11H5Cl3IN and a molecular weight of 384.43 g/mol. Its IUPAC name is 5-chloro-2-(2,4-dichlorophenyl)-3-iodopyridine.

Molecular Properties

Compound Name5-chloro-2-(2,4-dichlorophenyl)-3-iodopyridine
PubChem CID133088212
Molecular FormulaC11H5Cl3IN
Molecular Weight384.43 g/mol
Exact Mass382.85
IUPAC Name5-chloro-2-(2,4-dichlorophenyl)-3-iodopyridine
SMILESClc1ccc(-c2ncc(Cl)cc2I)c(Cl)c1
InChIInChI=1S/C11H5Cl3IN/c12-6-1-2-8(9(14)3-6)11-10(15)4-7(13)5-16-11/h1-5H
InChIKeyKZTFRZFLPSNTDK-UHFFFAOYSA-N
XLogP5.31
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500384.43
LogP ≤ 55.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}

Analyze 5-chloro-2-(2,4-dichlorophenyl)-3-iodopyridine 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 5-chloro-2-(2,4-dichlorophenyl)-3-iodopyridine?
The IUPAC name of 5-chloro-2-(2,4-dichlorophenyl)-3-iodopyridine (CID 133088212) is 5-chloro-2-(2,4-dichlorophenyl)-3-iodopyridine.
What is the SMILES notation for 5-chloro-2-(2,4-dichlorophenyl)-3-iodopyridine?
The canonical SMILES for 5-chloro-2-(2,4-dichlorophenyl)-3-iodopyridine is Clc1ccc(-c2ncc(Cl)cc2I)c(Cl)c1.
What is the InChIKey of 5-chloro-2-(2,4-dichlorophenyl)-3-iodopyridine?
The InChIKey is KZTFRZFLPSNTDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H5Cl3IN/c12-6-1-2-8(9(14)3-6)11-10(15)4-7(13)5-16-11/h1-5H.
What are the key properties of 5-chloro-2-(2,4-dichlorophenyl)-3-iodopyridine?
5-chloro-2-(2,4-dichlorophenyl)-3-iodopyridine has a molecular weight of 384.43 g/mol, XLogP of 5.31, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-(2,4-dichlorophenyl)-3-iodopyridine is sourced from PubChem (CID 133088212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).