2-(3-chloro-2-iodophenyl)pyridine

C11H7ClIN — CID 11290028

IUPAC2-(3-chloro-2-iodophenyl)pyridine
SMILESClc1cccc(-c2ccccn2)c1I
InChIInChI=1S/C11H7ClIN/c12-9-5-3-4-8(11(9)13)10-6-1-2-7-14-10/h1-7H
InChIKeySGJMGZBPUDTSIH-UHFFFAOYSA-N
MW315.54 g/mol
LogP4.01
Rot. Bonds1

About 2-(3-chloro-2-iodophenyl)pyridine

2-(3-chloro-2-iodophenyl)pyridine (PubChem CID 11290028) has the molecular formula C11H7ClIN and a molecular weight of 315.54 g/mol. Its IUPAC name is 2-(3-chloro-2-iodophenyl)pyridine.

Molecular Properties

Compound Name2-(3-chloro-2-iodophenyl)pyridine
PubChem CID11290028
Molecular FormulaC11H7ClIN
Molecular Weight315.54 g/mol
Exact Mass314.93
IUPAC Name2-(3-chloro-2-iodophenyl)pyridine
SMILESClc1cccc(-c2ccccn2)c1I
InChIInChI=1S/C11H7ClIN/c12-9-5-3-4-8(11(9)13)10-6-1-2-7-14-10/h1-7H
InChIKeySGJMGZBPUDTSIH-UHFFFAOYSA-N
XLogP4.01
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.54
LogP ≤ 54.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(3-chloro-2-iodophenyl)pyridine?
The IUPAC name of 2-(3-chloro-2-iodophenyl)pyridine (CID 11290028) is 2-(3-chloro-2-iodophenyl)pyridine.
What is the SMILES notation for 2-(3-chloro-2-iodophenyl)pyridine?
The canonical SMILES for 2-(3-chloro-2-iodophenyl)pyridine is Clc1cccc(-c2ccccn2)c1I.
What is the InChIKey of 2-(3-chloro-2-iodophenyl)pyridine?
The InChIKey is SGJMGZBPUDTSIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7ClIN/c12-9-5-3-4-8(11(9)13)10-6-1-2-7-14-10/h1-7H.
What are the key properties of 2-(3-chloro-2-iodophenyl)pyridine?
2-(3-chloro-2-iodophenyl)pyridine has a molecular weight of 315.54 g/mol, XLogP of 4.01, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chloro-2-iodophenyl)pyridine is sourced from PubChem (CID 11290028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).