2-(difluoromethyl)-3-fluoro-5,6-diiodopyridine

C6H2F3I2N — CID 130100474

IUPAC2-(difluoromethyl)-3-fluoro-5,6-diiodopyridine
SMILESFc1cc(I)c(I)nc1C(F)F
InChIInChI=1S/C6H2F3I2N/c7-2-1-3(10)6(11)12-4(2)5(8)9/h1,5H
InChIKeyRDBRFZDYEPKTEC-UHFFFAOYSA-N
MW398.89 g/mol
LogP3.37
Rot. Bonds1

About 2-(difluoromethyl)-3-fluoro-5,6-diiodopyridine

2-(difluoromethyl)-3-fluoro-5,6-diiodopyridine (PubChem CID 130100474) has the molecular formula C6H2F3I2N and a molecular weight of 398.89 g/mol. Its IUPAC name is 2-(difluoromethyl)-3-fluoro-5,6-diiodopyridine.

Molecular Properties

Compound Name2-(difluoromethyl)-3-fluoro-5,6-diiodopyridine
PubChem CID130100474
Molecular FormulaC6H2F3I2N
Molecular Weight398.89 g/mol
Exact Mass398.82
IUPAC Name2-(difluoromethyl)-3-fluoro-5,6-diiodopyridine
SMILESFc1cc(I)c(I)nc1C(F)F
InChIInChI=1S/C6H2F3I2N/c7-2-1-3(10)6(11)12-4(2)5(8)9/h1,5H
InChIKeyRDBRFZDYEPKTEC-UHFFFAOYSA-N
XLogP3.37
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.89
LogP ≤ 53.37
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)-5,6-diiodo-3-pyridinyl]methanamine
CID 130100564
2-[2-(difluoromethyl)-5,6-diiodo-3-pyridinyl]acetic acid
CID 130100706
2-(difluoromethyl)-5-fluoro-6-iodo-3-methylpyridine
CID 130079892
[6-(difluoromethyl)-3-fluoro-5-iodo-2-pyridinyl]methanol
CID 118854432
6-(difluoromethyl)-2,5-diiodopyridin-3-amine
CID 130100401
6-(difluoromethyl)-3,5-difluoropyridine-2-carbaldehyde
CID 130099862
ethyl 6-(difluoromethyl)-5-fluoro-2-iodopyridine-3-carboxylate
CID 133106006
2-(difluoromethyl)-5-fluoro-6-iodopyridine-3-carboxylic acid
CID 118837565
2-(difluoromethyl)-6-fluoro-3,4-diiodopyridine
CID 118842841
2-(difluoromethyl)-3,6-difluoro-5-methylpyridine
CID 130099696
6-(difluoromethyl)-5-fluoropyridine-2,3-diamine
CID 130098596
6-(difluoromethyl)-2,5-difluoropyridin-3-amine
CID 130099529

Frequently Asked Questions

What is the IUPAC name of 2-(difluoromethyl)-3-fluoro-5,6-diiodopyridine?
The IUPAC name of 2-(difluoromethyl)-3-fluoro-5,6-diiodopyridine (CID 130100474) is 2-(difluoromethyl)-3-fluoro-5,6-diiodopyridine.
What is the SMILES notation for 2-(difluoromethyl)-3-fluoro-5,6-diiodopyridine?
The canonical SMILES for 2-(difluoromethyl)-3-fluoro-5,6-diiodopyridine is Fc1cc(I)c(I)nc1C(F)F.
What is the InChIKey of 2-(difluoromethyl)-3-fluoro-5,6-diiodopyridine?
The InChIKey is RDBRFZDYEPKTEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H2F3I2N/c7-2-1-3(10)6(11)12-4(2)5(8)9/h1,5H.
What are the key properties of 2-(difluoromethyl)-3-fluoro-5,6-diiodopyridine?
2-(difluoromethyl)-3-fluoro-5,6-diiodopyridine has a molecular weight of 398.89 g/mol, XLogP of 3.37, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(difluoromethyl)-3-fluoro-5,6-diiodopyridine is sourced from PubChem (CID 130100474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).