2-bromo-6-iodopyridine

C5H3BrIN — CID 11312130

IUPAC2-bromo-6-iodopyridine
SMILESBrc1cccc(I)n1
InChIInChI=1S/C5H3BrIN/c6-4-2-1-3-5(7)8-4/h1-3H
InChIKeyKJOQMWRTNVBXEV-UHFFFAOYSA-N
MW283.89 g/mol
LogP2.45
Rot. Bonds

About 2-bromo-6-iodopyridine

2-bromo-6-iodopyridine (PubChem CID 11312130) has the molecular formula C5H3BrIN and a molecular weight of 283.89 g/mol. Its IUPAC name is 2-bromo-6-iodopyridine.

Molecular Properties

Compound Name2-bromo-6-iodopyridine
PubChem CID11312130
Molecular FormulaC5H3BrIN
Molecular Weight283.89 g/mol
Exact Mass282.85
IUPAC Name2-bromo-6-iodopyridine
SMILESBrc1cccc(I)n1
InChIInChI=1S/C5H3BrIN/c6-4-2-1-3-5(7)8-4/h1-3H
InChIKeyKJOQMWRTNVBXEV-UHFFFAOYSA-N
XLogP2.45
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.89
LogP ≤ 52.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-bromo-6-iodopyridine?
The IUPAC name of 2-bromo-6-iodopyridine (CID 11312130) is 2-bromo-6-iodopyridine.
What is the SMILES notation for 2-bromo-6-iodopyridine?
The canonical SMILES for 2-bromo-6-iodopyridine is Brc1cccc(I)n1.
What is the InChIKey of 2-bromo-6-iodopyridine?
The InChIKey is KJOQMWRTNVBXEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H3BrIN/c6-4-2-1-3-5(7)8-4/h1-3H.
What are the key properties of 2-bromo-6-iodopyridine?
2-bromo-6-iodopyridine has a molecular weight of 283.89 g/mol, XLogP of 2.45, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-6-iodopyridine is sourced from PubChem (CID 11312130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).