2-(difluoromethyl)-4,6-difluoro-3-iodopyridine

C6H2F4IN — CID 118846195

IUPAC2-(difluoromethyl)-4,6-difluoro-3-iodopyridine
SMILESFc1cc(F)c(I)c(C(F)F)n1
InChIInChI=1S/C6H2F4IN/c7-2-1-3(8)12-5(4(2)11)6(9)10/h1,6H
InChIKeySABMHPSRHBLELQ-UHFFFAOYSA-N
MW290.99 g/mol
LogP2.90
Rot. Bonds1

About 2-(difluoromethyl)-4,6-difluoro-3-iodopyridine

2-(difluoromethyl)-4,6-difluoro-3-iodopyridine (PubChem CID 118846195) has the molecular formula C6H2F4IN and a molecular weight of 290.99 g/mol. Its IUPAC name is 2-(difluoromethyl)-4,6-difluoro-3-iodopyridine.

Molecular Properties

Compound Name2-(difluoromethyl)-4,6-difluoro-3-iodopyridine
PubChem CID118846195
Molecular FormulaC6H2F4IN
Molecular Weight290.99 g/mol
Exact Mass290.92
IUPAC Name2-(difluoromethyl)-4,6-difluoro-3-iodopyridine
SMILESFc1cc(F)c(I)c(C(F)F)n1
InChIInChI=1S/C6H2F4IN/c7-2-1-3(8)12-5(4(2)11)6(9)10/h1,6H
InChIKeySABMHPSRHBLELQ-UHFFFAOYSA-N
XLogP2.90
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.99
LogP ≤ 52.90
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-(difluoromethyl)-6-fluoro-3,4-diiodopyridine
CID 118842841
4-(bromomethyl)-2-(difluoromethyl)-6-fluoro-3-iodopyridine
CID 130080031
2-(difluoromethyl)-6-fluoro-3-iodo-4-methoxypyridine
CID 118826386
2-(difluoromethyl)-4,6-difluoro-3-methylpyridine
CID 118851823
2-(difluoromethyl)-6-fluoro-4-iodopyridin-3-ol
CID 118854339
3-(bromomethyl)-2-(difluoromethyl)-4,6-difluoropyridine
CID 130099754
2-(difluoromethyl)-3-fluoro-5,6-diiodopyridine
CID 130100474
3,4-dichloro-2-(difluoromethyl)-6-fluoropyridine
CID 130099210
[3-bromo-2-(difluoromethyl)-6-fluoro-4-pyridinyl]methanamine
CID 118823517
3-(difluoromethyl)-2,4,6-trifluoropyridine
CID 130088806
methyl 2-(difluoromethyl)-4,6-difluoropyridine-3-carboxylate
CID 134664214
2-[2-(difluoromethyl)-3,6-difluoro-4-pyridinyl]acetonitrile
CID 130099810

Frequently Asked Questions

What is the IUPAC name of 2-(difluoromethyl)-4,6-difluoro-3-iodopyridine?
The IUPAC name of 2-(difluoromethyl)-4,6-difluoro-3-iodopyridine (CID 118846195) is 2-(difluoromethyl)-4,6-difluoro-3-iodopyridine.
What is the SMILES notation for 2-(difluoromethyl)-4,6-difluoro-3-iodopyridine?
The canonical SMILES for 2-(difluoromethyl)-4,6-difluoro-3-iodopyridine is Fc1cc(F)c(I)c(C(F)F)n1.
What is the InChIKey of 2-(difluoromethyl)-4,6-difluoro-3-iodopyridine?
The InChIKey is SABMHPSRHBLELQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H2F4IN/c7-2-1-3(8)12-5(4(2)11)6(9)10/h1,6H.
What are the key properties of 2-(difluoromethyl)-4,6-difluoro-3-iodopyridine?
2-(difluoromethyl)-4,6-difluoro-3-iodopyridine has a molecular weight of 290.99 g/mol, XLogP of 2.90, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(difluoromethyl)-4,6-difluoro-3-iodopyridine is sourced from PubChem (CID 118846195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).