2,3-dichloro-4-(2-chloro-4-iodophenoxy)pyridine

C11H5Cl3INO — CID 134813639

IUPAC2,3-dichloro-4-(2-chloro-4-iodophenoxy)pyridine
SMILESClc1cc(I)ccc1Oc1ccnc(Cl)c1Cl
InChIInChI=1S/C11H5Cl3INO/c12-7-5-6(15)1-2-8(7)17-9-3-4-16-11(14)10(9)13/h1-5H
InChIKeyWFORDWRKKGDLHF-UHFFFAOYSA-N
MW400.43 g/mol
LogP5.44
Rot. Bonds2

About 2,3-dichloro-4-(2-chloro-4-iodophenoxy)pyridine

2,3-dichloro-4-(2-chloro-4-iodophenoxy)pyridine (PubChem CID 134813639) has the molecular formula C11H5Cl3INO and a molecular weight of 400.43 g/mol. Its IUPAC name is 2,3-dichloro-4-(2-chloro-4-iodophenoxy)pyridine.

Molecular Properties

Compound Name2,3-dichloro-4-(2-chloro-4-iodophenoxy)pyridine
PubChem CID134813639
Molecular FormulaC11H5Cl3INO
Molecular Weight400.43 g/mol
Exact Mass398.85
IUPAC Name2,3-dichloro-4-(2-chloro-4-iodophenoxy)pyridine
SMILESClc1cc(I)ccc1Oc1ccnc(Cl)c1Cl
InChIInChI=1S/C11H5Cl3INO/c12-7-5-6(15)1-2-8(7)17-9-3-4-16-11(14)10(9)13/h1-5H
InChIKeyWFORDWRKKGDLHF-UHFFFAOYSA-N
XLogP5.44
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500400.43
LogP ≤ 55.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 2,3-dichloro-4-(2-chloro-4-iodophenoxy)pyridine with MolForge

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

Launch Full Analysis

Related Compounds

4-(4-bromo-2-chlorophenoxy)-2,3-dichloropyridine
CID 155316701
3-chloro-4-(2-chloro-4-iodophenoxy)-2-(4-methylpiperidin-1-yl)pyridine;2,3-dichloro-4-(2-chloro-4-iodophenoxy)pyridine;4-methylpiperidine
CID 159537114
3-chloro-4-quinolin-4-yloxyaniline
CID 61341550
6-(2-chloro-4-iodophenoxy)-[1,2,4]triazolo[1,5-a]pyridine
CID 178068943
3-chloro-4-(7-methoxyquinolin-4-yl)oxyaniline
CID 90017152
2-(2-chloro-5-methylphenoxy)-5-iodoaniline
CID 66081953
2-(2-chloro-4-methylphenoxy)pyridin-4-amine
CID 62670410
2,3-dichloro-4-[4-(trifluoromethyl)phenoxy]pyridine;2,3,4-trichloropyridine;4-(trifluoromethyl)phenol
CID 164959559
2,3-dichloro-4-(2,4,6-trichlorophenyl)pyridine
CID 134636139
3-chloro-4-(4-iodophenoxy)benzonitrile
CID 55221862
4-(2-chloro-4-methylphenoxy)-3-iodoaniline
CID 66094007
3-chloro-2-(2,4-dichlorophenoxy)pyridine-4-carbonitrile
CID 107058848

Frequently Asked Questions

What is the IUPAC name of 2,3-dichloro-4-(2-chloro-4-iodophenoxy)pyridine?
The IUPAC name of 2,3-dichloro-4-(2-chloro-4-iodophenoxy)pyridine (CID 134813639) is 2,3-dichloro-4-(2-chloro-4-iodophenoxy)pyridine.
What is the SMILES notation for 2,3-dichloro-4-(2-chloro-4-iodophenoxy)pyridine?
The canonical SMILES for 2,3-dichloro-4-(2-chloro-4-iodophenoxy)pyridine is Clc1cc(I)ccc1Oc1ccnc(Cl)c1Cl.
What is the InChIKey of 2,3-dichloro-4-(2-chloro-4-iodophenoxy)pyridine?
The InChIKey is WFORDWRKKGDLHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H5Cl3INO/c12-7-5-6(15)1-2-8(7)17-9-3-4-16-11(14)10(9)13/h1-5H.
What are the key properties of 2,3-dichloro-4-(2-chloro-4-iodophenoxy)pyridine?
2,3-dichloro-4-(2-chloro-4-iodophenoxy)pyridine has a molecular weight of 400.43 g/mol, XLogP of 5.44, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dichloro-4-(2-chloro-4-iodophenoxy)pyridine is sourced from PubChem (CID 134813639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).