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

C6H2ClF2I2N — CID 130100430

IUPAC5-chloro-4-(difluoromethyl)-2,3-diiodopyridine
SMILESFC(F)c1c(Cl)cnc(I)c1I
InChIInChI=1S/C6H2ClF2I2N/c7-2-1-12-6(11)4(10)3(2)5(8)9/h1,5H
InChIKeyWNORUUWPHPTWPS-UHFFFAOYSA-N
MW415.35 g/mol
LogP3.88
Rot. Bonds1

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

5-chloro-4-(difluoromethyl)-2,3-diiodopyridine (PubChem CID 130100430) has the molecular formula C6H2ClF2I2N and a molecular weight of 415.35 g/mol. Its IUPAC name is 5-chloro-4-(difluoromethyl)-2,3-diiodopyridine.

Molecular Properties

Compound Name5-chloro-4-(difluoromethyl)-2,3-diiodopyridine
PubChem CID130100430
Molecular FormulaC6H2ClF2I2N
Molecular Weight415.35 g/mol
Exact Mass414.79
IUPAC Name5-chloro-4-(difluoromethyl)-2,3-diiodopyridine
SMILESFC(F)c1c(Cl)cnc(I)c1I
InChIInChI=1S/C6H2ClF2I2N/c7-2-1-12-6(11)4(10)3(2)5(8)9/h1,5H
InChIKeyWNORUUWPHPTWPS-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

4-(difluoromethyl)-5,6-diiodopyridin-3-amine
CID 130100391
5-chloro-3-(difluoromethyl)-2-fluoro-4-iodopyridine
CID 130071565
methyl 5-chloro-4-(difluoromethyl)-2-iodopyridine-3-carboxylate
CID 130073412
5-chloro-2-(difluoromethyl)-3,4-diiodopyridine
CID 130100445
4-chloro-3-(difluoromethyl)-2-iodo-5-methylpyridine
CID 118822414
2-bromo-3,5-dichloro-4-(difluoromethyl)pyridine
CID 119019803
5-chloro-4-(difluoromethyl)-2-iodopyridine
CID 130095401
3-chloro-5-(chloromethyl)-4-(difluoromethyl)-2-iodopyridine
CID 130073184
4-bromo-5-(difluoromethyl)-2,3-diiodopyridine
CID 118806090
1-chloro-2-(difluoromethyl)-4-fluoro-3-iodobenzene
CID 171004047
4-chloro-5-(difluoromethyl)-2-iodopyridine
CID 118845024
3,5-dichloro-4-(difluoromethyl)-2-methoxypyridine
CID 130099252

Frequently Asked Questions

What is the IUPAC name of 5-chloro-4-(difluoromethyl)-2,3-diiodopyridine?
The IUPAC name of 5-chloro-4-(difluoromethyl)-2,3-diiodopyridine (CID 130100430) is 5-chloro-4-(difluoromethyl)-2,3-diiodopyridine.
What is the SMILES notation for 5-chloro-4-(difluoromethyl)-2,3-diiodopyridine?
The canonical SMILES for 5-chloro-4-(difluoromethyl)-2,3-diiodopyridine is FC(F)c1c(Cl)cnc(I)c1I.
What is the InChIKey of 5-chloro-4-(difluoromethyl)-2,3-diiodopyridine?
The InChIKey is WNORUUWPHPTWPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H2ClF2I2N/c7-2-1-12-6(11)4(10)3(2)5(8)9/h1,5H.
What are the key properties of 5-chloro-4-(difluoromethyl)-2,3-diiodopyridine?
5-chloro-4-(difluoromethyl)-2,3-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 5-chloro-4-(difluoromethyl)-2,3-diiodopyridine is sourced from PubChem (CID 130100430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).