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

C6H2ClF2I2N — CID 119016317

IUPAC2-chloro-5-(difluoromethyl)-3,6-diiodopyridine
SMILESFC(F)c1cc(I)c(Cl)nc1I
InChIInChI=1S/C6H2ClF2I2N/c7-4-3(10)1-2(5(8)9)6(11)12-4/h1,5H
InChIKeyKEKHNJVJTZYIPS-UHFFFAOYSA-N
MW415.35 g/mol
LogP3.88
Rot. Bonds1

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

2-chloro-5-(difluoromethyl)-3,6-diiodopyridine (PubChem CID 119016317) has the molecular formula C6H2ClF2I2N and a molecular weight of 415.35 g/mol. Its IUPAC name is 2-chloro-5-(difluoromethyl)-3,6-diiodopyridine.

Molecular Properties

Compound Name2-chloro-5-(difluoromethyl)-3,6-diiodopyridine
PubChem CID119016317
Molecular FormulaC6H2ClF2I2N
Molecular Weight415.35 g/mol
Exact Mass414.79
IUPAC Name2-chloro-5-(difluoromethyl)-3,6-diiodopyridine
SMILESFC(F)c1cc(I)c(Cl)nc1I
InChIInChI=1S/C6H2ClF2I2N/c7-4-3(10)1-2(5(8)9)6(11)12-4/h1,5H
InChIKeyKEKHNJVJTZYIPS-UHFFFAOYSA-N
XLogP3.88
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500415.35
LogP ≤ 53.88
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-[6-chloro-3-(difluoromethyl)-5-iodo-2-pyridinyl]acetonitrile
CID 118999391
2-chloro-3-(difluoromethyl)-6-iodo-5-methylpyridine
CID 119010207
2-chloro-3-(difluoromethyl)-6-iodo-5-(trifluoromethyl)pyridine
CID 119007178
ethyl 2-[6-chloro-3-(difluoromethyl)-5-iodo-2-pyridinyl]acetate
CID 134673847
6-chloro-2-(difluoromethyl)-5-iodopyridine-3-carboxylic acid
CID 119006565
5-(difluoromethyl)-6-iodopyridine-2,3-diamine
CID 118990847
2-chloro-3-(chloromethyl)-4-(difluoromethyl)-6-iodopyridine
CID 119013287
5-(difluoromethyl)-3-fluoro-6-iodopyridine-2-carbonyl chloride
CID 130080391
5-(difluoromethyl)-2-fluoro-6-iodo-3-methylpyridine
CID 130079920
2-bromo-3-(chloromethyl)-5-(difluoromethyl)-6-iodopyridine
CID 119010218
5-(difluoromethyl)-6-iodo-2-methylpyridin-3-ol
CID 130082529
5-chloro-3-(difluoromethyl)-6-iodopyridin-2-amine
CID 119006864

Frequently Asked Questions

What is the IUPAC name of 2-chloro-5-(difluoromethyl)-3,6-diiodopyridine?
The IUPAC name of 2-chloro-5-(difluoromethyl)-3,6-diiodopyridine (CID 119016317) is 2-chloro-5-(difluoromethyl)-3,6-diiodopyridine.
What is the SMILES notation for 2-chloro-5-(difluoromethyl)-3,6-diiodopyridine?
The canonical SMILES for 2-chloro-5-(difluoromethyl)-3,6-diiodopyridine is FC(F)c1cc(I)c(Cl)nc1I.
What is the InChIKey of 2-chloro-5-(difluoromethyl)-3,6-diiodopyridine?
The InChIKey is KEKHNJVJTZYIPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H2ClF2I2N/c7-4-3(10)1-2(5(8)9)6(11)12-4/h1,5H.
What are the key properties of 2-chloro-5-(difluoromethyl)-3,6-diiodopyridine?
2-chloro-5-(difluoromethyl)-3,6-diiodopyridine has a molecular weight of 415.35 g/mol, XLogP of 3.88, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-5-(difluoromethyl)-3,6-diiodopyridine is sourced from PubChem (CID 119016317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).