5-bromo-4-chloro-2-(difluoromethyl)-3-iodopyridine

C6H2BrClF2IN — CID 130107883

IUPAC5-bromo-4-chloro-2-(difluoromethyl)-3-iodopyridine
SMILESFC(F)c1ncc(Br)c(Cl)c1I
InChIInChI=1S/C6H2BrClF2IN/c7-2-1-12-5(6(9)10)4(11)3(2)8/h1,6H
InChIKeyJULARZHGCHFFGF-UHFFFAOYSA-N
MW368.35 g/mol
LogP4.04
Rot. Bonds1

About 5-bromo-4-chloro-2-(difluoromethyl)-3-iodopyridine

5-bromo-4-chloro-2-(difluoromethyl)-3-iodopyridine (PubChem CID 130107883) has the molecular formula C6H2BrClF2IN and a molecular weight of 368.35 g/mol. Its IUPAC name is 5-bromo-4-chloro-2-(difluoromethyl)-3-iodopyridine.

Molecular Properties

Compound Name5-bromo-4-chloro-2-(difluoromethyl)-3-iodopyridine
PubChem CID130107883
Molecular FormulaC6H2BrClF2IN
Molecular Weight368.35 g/mol
Exact Mass366.81
IUPAC Name5-bromo-4-chloro-2-(difluoromethyl)-3-iodopyridine
SMILESFC(F)c1ncc(Br)c(Cl)c1I
InChIInChI=1S/C6H2BrClF2IN/c7-2-1-12-5(6(9)10)4(11)3(2)8/h1,6H
InChIKeyJULARZHGCHFFGF-UHFFFAOYSA-N
XLogP4.04
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.35
LogP ≤ 54.04
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-chloro-2-(difluoromethyl)-3,4-diiodopyridine
CID 130100445
2-[5-bromo-2-(difluoromethyl)-3-iodo-4-pyridinyl]acetic acid
CID 130068482
5-bromo-2-(difluoromethyl)-4-iodo-3-(trifluoromethyl)pyridine
CID 134670864
3-chloro-5-(chloromethyl)-2-(difluoromethyl)-4-iodopyridine
CID 130073182
methyl 5-bromo-2-(difluoromethyl)-3-iodopyridine-4-carboxylate
CID 134684442
2-[5-bromo-3-chloro-2-(difluoromethyl)-4-pyridinyl]acetic acid
CID 130108376
2-[5-bromo-2-(difluoromethyl)-4-iodo-3-pyridinyl]acetonitrile
CID 130068353
6-(difluoromethyl)-4,5-diiodopyridin-3-ol
CID 118843088
5-chloro-2-(difluoromethyl)-3-iodo-4-nitropyridine
CID 130073070
5-bromo-2-(difluoromethyl)-3-iodopyridine
CID 130095025
2-(difluoromethyl)-3-iodo-4,5-dimethylpyridine
CID 130101179
4-bromo-6-(difluoromethyl)-5-iodopyridine-3-carboxamide
CID 118806222

Frequently Asked Questions

What is the IUPAC name of 5-bromo-4-chloro-2-(difluoromethyl)-3-iodopyridine?
The IUPAC name of 5-bromo-4-chloro-2-(difluoromethyl)-3-iodopyridine (CID 130107883) is 5-bromo-4-chloro-2-(difluoromethyl)-3-iodopyridine.
What is the SMILES notation for 5-bromo-4-chloro-2-(difluoromethyl)-3-iodopyridine?
The canonical SMILES for 5-bromo-4-chloro-2-(difluoromethyl)-3-iodopyridine is FC(F)c1ncc(Br)c(Cl)c1I.
What is the InChIKey of 5-bromo-4-chloro-2-(difluoromethyl)-3-iodopyridine?
The InChIKey is JULARZHGCHFFGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H2BrClF2IN/c7-2-1-12-5(6(9)10)4(11)3(2)8/h1,6H.
What are the key properties of 5-bromo-4-chloro-2-(difluoromethyl)-3-iodopyridine?
5-bromo-4-chloro-2-(difluoromethyl)-3-iodopyridine has a molecular weight of 368.35 g/mol, XLogP of 4.04, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-4-chloro-2-(difluoromethyl)-3-iodopyridine is sourced from PubChem (CID 130107883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).