(3-pyridin-2-ylphenyl) hypoiodite

C11H8INO — CID 143814721

IUPAC(3-pyridin-2-ylphenyl) hypoiodite
SMILESIOc1cccc(-c2ccccn2)c1
InChIInChI=1S/C11H8INO/c12-14-10-5-3-4-9(8-10)11-6-1-2-7-13-11/h1-8H
InChIKeyANVRBRYSGMCSGY-UHFFFAOYSA-N
MW297.10 g/mol
LogP3.48
Rot. Bonds2

About (3-pyridin-2-ylphenyl) hypoiodite

(3-pyridin-2-ylphenyl) hypoiodite (PubChem CID 143814721) has the molecular formula C11H8INO and a molecular weight of 297.10 g/mol. Its IUPAC name is (3-pyridin-2-ylphenyl) hypoiodite.

Molecular Properties

Compound Name(3-pyridin-2-ylphenyl) hypoiodite
PubChem CID143814721
Molecular FormulaC11H8INO
Molecular Weight297.10 g/mol
Exact Mass296.97
IUPAC Name(3-pyridin-2-ylphenyl) hypoiodite
SMILESIOc1cccc(-c2ccccn2)c1
InChIInChI=1S/C11H8INO/c12-14-10-5-3-4-9(8-10)11-6-1-2-7-13-11/h1-8H
InChIKeyANVRBRYSGMCSGY-UHFFFAOYSA-N
XLogP3.48
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.10
LogP ≤ 53.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze (3-pyridin-2-ylphenyl) hypoiodite 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 (3-pyridin-2-ylphenyl) hypoiodite?
The IUPAC name of (3-pyridin-2-ylphenyl) hypoiodite (CID 143814721) is (3-pyridin-2-ylphenyl) hypoiodite.
What is the SMILES notation for (3-pyridin-2-ylphenyl) hypoiodite?
The canonical SMILES for (3-pyridin-2-ylphenyl) hypoiodite is IOc1cccc(-c2ccccn2)c1.
What is the InChIKey of (3-pyridin-2-ylphenyl) hypoiodite?
The InChIKey is ANVRBRYSGMCSGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8INO/c12-14-10-5-3-4-9(8-10)11-6-1-2-7-13-11/h1-8H.
What are the key properties of (3-pyridin-2-ylphenyl) hypoiodite?
(3-pyridin-2-ylphenyl) hypoiodite has a molecular weight of 297.10 g/mol, XLogP of 3.48, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3-pyridin-2-ylphenyl) hypoiodite is sourced from PubChem (CID 143814721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).