5-(4-iodophenyl)-2-methoxypyridine

C12H10INO — CID 121329970

IUPAC5-(4-iodophenyl)-2-methoxypyridine
SMILESCOc1ccc(-c2ccc(I)cc2)cn1
InChIInChI=1S/C12H10INO/c1-15-12-7-4-10(8-14-12)9-2-5-11(13)6-3-9/h2-8H,1H3
InChIKeyUSCPYLJOISBWQT-UHFFFAOYSA-N
MW311.12 g/mol
LogP3.36
Rot. Bonds2

About 5-(4-iodophenyl)-2-methoxypyridine

5-(4-iodophenyl)-2-methoxypyridine (PubChem CID 121329970) has the molecular formula C12H10INO and a molecular weight of 311.12 g/mol. Its IUPAC name is 5-(4-iodophenyl)-2-methoxypyridine.

Molecular Properties

Compound Name5-(4-iodophenyl)-2-methoxypyridine
PubChem CID121329970
Molecular FormulaC12H10INO
Molecular Weight311.12 g/mol
Exact Mass310.98
IUPAC Name5-(4-iodophenyl)-2-methoxypyridine
SMILESCOc1ccc(-c2ccc(I)cc2)cn1
InChIInChI=1S/C12H10INO/c1-15-12-7-4-10(8-14-12)9-2-5-11(13)6-3-9/h2-8H,1H3
InChIKeyUSCPYLJOISBWQT-UHFFFAOYSA-N
XLogP3.36
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.12
LogP ≤ 53.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 5-(4-iodophenyl)-2-methoxypyridine 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-(4-iodophenyl)-2-methoxypyridine?
The IUPAC name of 5-(4-iodophenyl)-2-methoxypyridine (CID 121329970) is 5-(4-iodophenyl)-2-methoxypyridine.
What is the SMILES notation for 5-(4-iodophenyl)-2-methoxypyridine?
The canonical SMILES for 5-(4-iodophenyl)-2-methoxypyridine is COc1ccc(-c2ccc(I)cc2)cn1.
What is the InChIKey of 5-(4-iodophenyl)-2-methoxypyridine?
The InChIKey is USCPYLJOISBWQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10INO/c1-15-12-7-4-10(8-14-12)9-2-5-11(13)6-3-9/h2-8H,1H3.
What are the key properties of 5-(4-iodophenyl)-2-methoxypyridine?
5-(4-iodophenyl)-2-methoxypyridine has a molecular weight of 311.12 g/mol, XLogP of 3.36, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-iodophenyl)-2-methoxypyridine is sourced from PubChem (CID 121329970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).