5-chloro-3-fluoro-2-(2-iodophenoxy)pyridine

C11H6ClFINO — CID 79727918

IUPAC5-chloro-3-fluoro-2-(2-iodophenoxy)pyridine
SMILESFc1cc(Cl)cnc1Oc1ccccc1I
InChIInChI=1S/C11H6ClFINO/c12-7-5-8(13)11(15-6-7)16-10-4-2-1-3-9(10)14/h1-6H
InChIKeyKWGDDLQCRYJVRM-UHFFFAOYSA-N
MW349.53 g/mol
LogP4.27
Rot. Bonds2

About 5-chloro-3-fluoro-2-(2-iodophenoxy)pyridine

5-chloro-3-fluoro-2-(2-iodophenoxy)pyridine (PubChem CID 79727918) has the molecular formula C11H6ClFINO and a molecular weight of 349.53 g/mol. Its IUPAC name is 5-chloro-3-fluoro-2-(2-iodophenoxy)pyridine.

Molecular Properties

Compound Name5-chloro-3-fluoro-2-(2-iodophenoxy)pyridine
PubChem CID79727918
Molecular FormulaC11H6ClFINO
Molecular Weight349.53 g/mol
Exact Mass348.92
IUPAC Name5-chloro-3-fluoro-2-(2-iodophenoxy)pyridine
SMILESFc1cc(Cl)cnc1Oc1ccccc1I
InChIInChI=1S/C11H6ClFINO/c12-7-5-8(13)11(15-6-7)16-10-4-2-1-3-9(10)14/h1-6H
InChIKeyKWGDDLQCRYJVRM-UHFFFAOYSA-N
XLogP4.27
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.53
LogP ≤ 54.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-3-fluoro-2-(2-iodophenoxy)pyridine?
The IUPAC name of 5-chloro-3-fluoro-2-(2-iodophenoxy)pyridine (CID 79727918) is 5-chloro-3-fluoro-2-(2-iodophenoxy)pyridine.
What is the SMILES notation for 5-chloro-3-fluoro-2-(2-iodophenoxy)pyridine?
The canonical SMILES for 5-chloro-3-fluoro-2-(2-iodophenoxy)pyridine is Fc1cc(Cl)cnc1Oc1ccccc1I.
What is the InChIKey of 5-chloro-3-fluoro-2-(2-iodophenoxy)pyridine?
The InChIKey is KWGDDLQCRYJVRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H6ClFINO/c12-7-5-8(13)11(15-6-7)16-10-4-2-1-3-9(10)14/h1-6H.
What are the key properties of 5-chloro-3-fluoro-2-(2-iodophenoxy)pyridine?
5-chloro-3-fluoro-2-(2-iodophenoxy)pyridine has a molecular weight of 349.53 g/mol, XLogP of 4.27, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-3-fluoro-2-(2-iodophenoxy)pyridine is sourced from PubChem (CID 79727918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).