5-(difluoromethyl)-2-fluoro-3,4-diiodopyridine

C6H2F3I2N — CID 130100485

IUPAC5-(difluoromethyl)-2-fluoro-3,4-diiodopyridine
SMILESFc1ncc(C(F)F)c(I)c1I
InChIInChI=1S/C6H2F3I2N/c7-5(8)2-1-12-6(9)4(11)3(2)10/h1,5H
InChIKeyIPURDSRFUPWKIW-UHFFFAOYSA-N
MW398.89 g/mol
LogP3.37
Rot. Bonds1

About 5-(difluoromethyl)-2-fluoro-3,4-diiodopyridine

5-(difluoromethyl)-2-fluoro-3,4-diiodopyridine (PubChem CID 130100485) has the molecular formula C6H2F3I2N and a molecular weight of 398.89 g/mol. Its IUPAC name is 5-(difluoromethyl)-2-fluoro-3,4-diiodopyridine.

Molecular Properties

Compound Name5-(difluoromethyl)-2-fluoro-3,4-diiodopyridine
PubChem CID130100485
Molecular FormulaC6H2F3I2N
Molecular Weight398.89 g/mol
Exact Mass398.82
IUPAC Name5-(difluoromethyl)-2-fluoro-3,4-diiodopyridine
SMILESFc1ncc(C(F)F)c(I)c1I
InChIInChI=1S/C6H2F3I2N/c7-5(8)2-1-12-6(9)4(11)3(2)10/h1,5H
InChIKeyIPURDSRFUPWKIW-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

5-(difluoromethyl)-2-fluoro-4-iodo-3-methylpyridine
CID 130079918
5-(difluoromethyl)-3-fluoro-2,4-diiodopyridine
CID 130100477
5-(difluoromethyl)-2-fluoro-4-iodopyridine-3-carbaldehyde
CID 130080238
[5-(difluoromethyl)-3,4-diiodo-2-pyridinyl]methanamine
CID 118848069
5-(difluoromethyl)-3,4-diiodopyridine-2-carbonitrile
CID 118991428
4-(difluoromethyl)-2-fluoro-3-iodo-5-methylpyridine
CID 118840077
methyl 5-(difluoromethyl)-2-fluoro-3-iodopyridine-4-carboxylate
CID 130080332
4-bromo-5-(difluoromethyl)-2,3-diiodopyridine
CID 118806090
5-(difluoromethyl)-3,4-diiodopyridine-2-carbonyl chloride
CID 130100736
[5-(difluoromethyl)-2,4-diiodo-3-pyridinyl]methanamine
CID 130100567
3,4-dichloro-5-(difluoromethyl)-2-fluoropyridine
CID 130099211
3-(difluoromethyl)-2,5-difluoropyridine
CID 70480194

Frequently Asked Questions

What is the IUPAC name of 5-(difluoromethyl)-2-fluoro-3,4-diiodopyridine?
The IUPAC name of 5-(difluoromethyl)-2-fluoro-3,4-diiodopyridine (CID 130100485) is 5-(difluoromethyl)-2-fluoro-3,4-diiodopyridine.
What is the SMILES notation for 5-(difluoromethyl)-2-fluoro-3,4-diiodopyridine?
The canonical SMILES for 5-(difluoromethyl)-2-fluoro-3,4-diiodopyridine is Fc1ncc(C(F)F)c(I)c1I.
What is the InChIKey of 5-(difluoromethyl)-2-fluoro-3,4-diiodopyridine?
The InChIKey is IPURDSRFUPWKIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H2F3I2N/c7-5(8)2-1-12-6(9)4(11)3(2)10/h1,5H.
What are the key properties of 5-(difluoromethyl)-2-fluoro-3,4-diiodopyridine?
5-(difluoromethyl)-2-fluoro-3,4-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 5-(difluoromethyl)-2-fluoro-3,4-diiodopyridine is sourced from PubChem (CID 130100485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).