5-chloro-4-(difluoromethyl)-2-iodopyridine

C6H3ClF2IN — CID 130095401

IUPAC5-chloro-4-(difluoromethyl)-2-iodopyridine
SMILESFC(F)c1cc(I)ncc1Cl
InChIInChI=1S/C6H3ClF2IN/c7-4-2-11-5(10)1-3(4)6(8)9/h1-2,6H
InChIKeySEJGKOWCILZYBS-UHFFFAOYSA-N
MW289.45 g/mol
LogP3.28
Rot. Bonds1

About 5-chloro-4-(difluoromethyl)-2-iodopyridine

5-chloro-4-(difluoromethyl)-2-iodopyridine (PubChem CID 130095401) has the molecular formula C6H3ClF2IN and a molecular weight of 289.45 g/mol. Its IUPAC name is 5-chloro-4-(difluoromethyl)-2-iodopyridine.

Molecular Properties

Compound Name5-chloro-4-(difluoromethyl)-2-iodopyridine
PubChem CID130095401
Molecular FormulaC6H3ClF2IN
Molecular Weight289.45 g/mol
Exact Mass288.90
IUPAC Name5-chloro-4-(difluoromethyl)-2-iodopyridine
SMILESFC(F)c1cc(I)ncc1Cl
InChIInChI=1S/C6H3ClF2IN/c7-4-2-11-5(10)1-3(4)6(8)9/h1-2,6H
InChIKeySEJGKOWCILZYBS-UHFFFAOYSA-N
XLogP3.28
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.45
LogP ≤ 53.28
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-chloro-5-(difluoromethyl)-2-iodopyridine
CID 118845024
5-chloro-3-(difluoromethyl)-6-iodopyridin-2-amine
CID 119006864
5-chloro-4-(difluoromethyl)-2,3-diiodopyridine
CID 130100430
2-[5-chloro-4-(difluoromethyl)-2-pyridinyl]acetic acid
CID 130095685
5-chloro-2-(difluoromethyl)-3,4-diiodopyridine
CID 130100445
methyl 2-[5-chloro-4-(difluoromethyl)-2-pyridinyl]acetate
CID 133088360
2-chloro-3-(chloromethyl)-4-(difluoromethyl)-6-iodopyridine
CID 119013287
4-chloro-5-(difluoromethyl)pyridine-2-sulfonamide
CID 130095774
5-chloro-3-(difluoromethyl)-2-fluoro-4-iodopyridine
CID 130071565
3-chloro-5-(difluoromethyl)-2-iodopyridin-4-amine
CID 118829021
4-(difluoromethyl)-3,6-diiodopyridine-2-sulfonyl chloride
CID 118829623
4-chloro-5-(difluoromethyl)-2-methoxypyridine
CID 118822541

Frequently Asked Questions

What is the IUPAC name of 5-chloro-4-(difluoromethyl)-2-iodopyridine?
The IUPAC name of 5-chloro-4-(difluoromethyl)-2-iodopyridine (CID 130095401) is 5-chloro-4-(difluoromethyl)-2-iodopyridine.
What is the SMILES notation for 5-chloro-4-(difluoromethyl)-2-iodopyridine?
The canonical SMILES for 5-chloro-4-(difluoromethyl)-2-iodopyridine is FC(F)c1cc(I)ncc1Cl.
What is the InChIKey of 5-chloro-4-(difluoromethyl)-2-iodopyridine?
The InChIKey is SEJGKOWCILZYBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H3ClF2IN/c7-4-2-11-5(10)1-3(4)6(8)9/h1-2,6H.
What are the key properties of 5-chloro-4-(difluoromethyl)-2-iodopyridine?
5-chloro-4-(difluoromethyl)-2-iodopyridine has a molecular weight of 289.45 g/mol, XLogP of 3.28, 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-iodopyridine is sourced from PubChem (CID 130095401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).