2-bromo-3,5-difluoro-6-iodopyridine

C5HBrF2IN — CID 177159493

IUPAC2-bromo-3,5-difluoro-6-iodopyridine
SMILESFc1cc(F)c(I)nc1Br
InChIInChI=1S/C5HBrF2IN/c6-4-2(7)1-3(8)5(9)10-4/h1H
InChIKeyMNIYEISVOZBFGE-UHFFFAOYSA-N
MW319.87 g/mol
LogP2.73
Rot. Bonds

About 2-bromo-3,5-difluoro-6-iodopyridine

2-bromo-3,5-difluoro-6-iodopyridine (PubChem CID 177159493) has the molecular formula C5HBrF2IN and a molecular weight of 319.87 g/mol. Its IUPAC name is 2-bromo-3,5-difluoro-6-iodopyridine.

Molecular Properties

Compound Name2-bromo-3,5-difluoro-6-iodopyridine
PubChem CID177159493
Molecular FormulaC5HBrF2IN
Molecular Weight319.87 g/mol
Exact Mass318.83
IUPAC Name2-bromo-3,5-difluoro-6-iodopyridine
SMILESFc1cc(F)c(I)nc1Br
InChIInChI=1S/C5HBrF2IN/c6-4-2(7)1-3(8)5(9)10-4/h1H
InChIKeyMNIYEISVOZBFGE-UHFFFAOYSA-N
XLogP2.73
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.87
LogP ≤ 52.73
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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Related Compounds

2-bromo-5-fluoro-6-iodopyridine-3-carboxylic acid
CID 168955979
2-bromo-3-fluoro-6-iodopyridine
CID 119011490
2-bromo-6-chloro-3-fluoro-5-methylpyridine
CID 130114370
6-bromo-3-(difluoromethyl)-4-fluoro-2-iodopyridine
CID 130109306
2-bromo-5-chloro-6-(difluoromethyl)-3-fluoropyridine
CID 118997697
2-(difluoromethyl)-5-fluoro-6-iodo-3-methylpyridine
CID 130079892
(2,5-dibromo-6-fluoropyrrolo[3,2-b]pyridin-1-yl) thiohypofluorite
CID 178060639
2-bromo-3,6-difluoro-5-(trifluoromethoxy)pyridine
CID 130094144
6-bromo-2-iodo-5-methylpyridin-3-ol
CID 178150998
[3-(difluoromethyl)-5-fluoro-6-iodo-2-pyridinyl]methanol
CID 130080196
6-bromo-5-fluoro-2-methylpyridine-3-carboxylic acid
CID 159654807
3-(difluoromethyl)-5-fluoro-6-iodopyridine-2-carboxylic acid
CID 130080267

Frequently Asked Questions

What is the IUPAC name of 2-bromo-3,5-difluoro-6-iodopyridine?
The IUPAC name of 2-bromo-3,5-difluoro-6-iodopyridine (CID 177159493) is 2-bromo-3,5-difluoro-6-iodopyridine.
What is the SMILES notation for 2-bromo-3,5-difluoro-6-iodopyridine?
The canonical SMILES for 2-bromo-3,5-difluoro-6-iodopyridine is Fc1cc(F)c(I)nc1Br.
What is the InChIKey of 2-bromo-3,5-difluoro-6-iodopyridine?
The InChIKey is MNIYEISVOZBFGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C5HBrF2IN/c6-4-2(7)1-3(8)5(9)10-4/h1H.
What are the key properties of 2-bromo-3,5-difluoro-6-iodopyridine?
2-bromo-3,5-difluoro-6-iodopyridine has a molecular weight of 319.87 g/mol, XLogP of 2.73, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-3,5-difluoro-6-iodopyridine is sourced from PubChem (CID 177159493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).