5-bromo-2-(difluoromethyl)-3-iodopyridine

C6H3BrF2IN — CID 130095025

IUPAC5-bromo-2-(difluoromethyl)-3-iodopyridine
SMILESFC(F)c1ncc(Br)cc1I
InChIInChI=1S/C6H3BrF2IN/c7-3-1-4(10)5(6(8)9)11-2-3/h1-2,6H
InChIKeyARSJXQJCLUUBOA-UHFFFAOYSA-N
MW333.90 g/mol
LogP3.39
Rot. Bonds1

About 5-bromo-2-(difluoromethyl)-3-iodopyridine

5-bromo-2-(difluoromethyl)-3-iodopyridine (PubChem CID 130095025) has the molecular formula C6H3BrF2IN and a molecular weight of 333.90 g/mol. Its IUPAC name is 5-bromo-2-(difluoromethyl)-3-iodopyridine.

Molecular Properties

Compound Name5-bromo-2-(difluoromethyl)-3-iodopyridine
PubChem CID130095025
Molecular FormulaC6H3BrF2IN
Molecular Weight333.90 g/mol
Exact Mass332.85
IUPAC Name5-bromo-2-(difluoromethyl)-3-iodopyridine
SMILESFC(F)c1ncc(Br)cc1I
InChIInChI=1S/C6H3BrF2IN/c7-3-1-4(10)5(6(8)9)11-2-3/h1-2,6H
InChIKeyARSJXQJCLUUBOA-UHFFFAOYSA-N
XLogP3.39
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.90
LogP ≤ 53.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

5-bromo-2-(difluoromethyl)-3-methylpyridine
CID 130095050
5-bromo-2-(difluoromethyl)pyridin-3-amine
CID 130094563
5-bromo-2-(difluoromethyl)pyridine-3-sulfonamide
CID 130095356
5-bromo-4-chloro-2-(difluoromethyl)-3-iodopyridine
CID 130107883
2-(difluoromethyl)-5-iodopyridin-3-amine
CID 130094620
5-bromo-2-(difluoromethyl)-4-iodopyridine
CID 130095026
5-bromo-2-(difluoromethyl)-4-iodo-3-(trifluoromethyl)pyridine
CID 134670864
2-[3-bromo-2-(difluoromethyl)-5-iodo-4-pyridinyl]acetic acid
CID 130068464
5-bromo-3-iodo-2-nitropyridine
CID 130647643
2-(difluoromethyl)-4-fluoro-5-iodopyridin-3-ol
CID 118820579
2-(difluoromethyl)-4-fluoro-5-iodopyridin-3-amine
CID 130103853
4-(bromomethyl)-2-(difluoromethyl)-5-iodopyridin-3-amine
CID 130105305

Frequently Asked Questions

What is the IUPAC name of 5-bromo-2-(difluoromethyl)-3-iodopyridine?
The IUPAC name of 5-bromo-2-(difluoromethyl)-3-iodopyridine (CID 130095025) is 5-bromo-2-(difluoromethyl)-3-iodopyridine.
What is the SMILES notation for 5-bromo-2-(difluoromethyl)-3-iodopyridine?
The canonical SMILES for 5-bromo-2-(difluoromethyl)-3-iodopyridine is FC(F)c1ncc(Br)cc1I.
What is the InChIKey of 5-bromo-2-(difluoromethyl)-3-iodopyridine?
The InChIKey is ARSJXQJCLUUBOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H3BrF2IN/c7-3-1-4(10)5(6(8)9)11-2-3/h1-2,6H.
What are the key properties of 5-bromo-2-(difluoromethyl)-3-iodopyridine?
5-bromo-2-(difluoromethyl)-3-iodopyridine has a molecular weight of 333.90 g/mol, XLogP of 3.39, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-2-(difluoromethyl)-3-iodopyridine is sourced from PubChem (CID 130095025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).