3-chloro-2-(difluoromethyl)-5-iodo-6-methylpyridine

C7H5ClF2IN — CID 130073015

IUPAC3-chloro-2-(difluoromethyl)-5-iodo-6-methylpyridine
SMILESCc1nc(C(F)F)c(Cl)cc1I
InChIInChI=1S/C7H5ClF2IN/c1-3-5(11)2-4(8)6(12-3)7(9)10/h2,7H,1H3
InChIKeyCCLLVOHRIMJOJS-UHFFFAOYSA-N
MW303.48 g/mol
LogP3.59
Rot. Bonds1

About 3-chloro-2-(difluoromethyl)-5-iodo-6-methylpyridine

3-chloro-2-(difluoromethyl)-5-iodo-6-methylpyridine (PubChem CID 130073015) has the molecular formula C7H5ClF2IN and a molecular weight of 303.48 g/mol. Its IUPAC name is 3-chloro-2-(difluoromethyl)-5-iodo-6-methylpyridine.

Molecular Properties

Compound Name3-chloro-2-(difluoromethyl)-5-iodo-6-methylpyridine
PubChem CID130073015
Molecular FormulaC7H5ClF2IN
Molecular Weight303.48 g/mol
Exact Mass302.91
IUPAC Name3-chloro-2-(difluoromethyl)-5-iodo-6-methylpyridine
SMILESCc1nc(C(F)F)c(Cl)cc1I
InChIInChI=1S/C7H5ClF2IN/c1-3-5(11)2-4(8)6(12-3)7(9)10/h2,7H,1H3
InChIKeyCCLLVOHRIMJOJS-UHFFFAOYSA-N
XLogP3.59
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.48
LogP ≤ 53.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

2-(difluoromethyl)-5-iodo-6-methylpyridine-3-carbonyl chloride
CID 118849139
5-chloro-6-(difluoromethyl)-3-iodopyridine-2-carbaldehyde
CID 130073315
[5-chloro-6-(difluoromethyl)-3-iodo-2-pyridinyl]methanamine
CID 118814520
5-chloro-6-(difluoromethyl)-3-iodopyridine-2-carboxylic acid
CID 130073352
ethyl 5-chloro-6-(difluoromethyl)-3-iodopyridine-2-carboxylate
CID 134677140
5-chloro-2-(difluoromethyl)-3-fluoro-6-methylpyridine
CID 130071645
5-chloro-2-(difluoromethyl)-6-fluoro-3-iodopyridine
CID 130071572
5-chloro-6-(difluoromethyl)-3-iodopyridine-2-sulfonamide
CID 130073589
3-chloro-2-(difluoromethyl)-6-iodo-4-methylpyridine
CID 130073016
[5-chloro-6-(difluoromethyl)-2-iodo-3-pyridinyl]methanol
CID 130073280
2-(bromomethyl)-5-chloro-6-(difluoromethyl)-3-methylpyridine
CID 130074149
3-chloro-2-(difluoromethyl)-6-methylpyridine
CID 130095432

Frequently Asked Questions

What is the IUPAC name of 3-chloro-2-(difluoromethyl)-5-iodo-6-methylpyridine?
The IUPAC name of 3-chloro-2-(difluoromethyl)-5-iodo-6-methylpyridine (CID 130073015) is 3-chloro-2-(difluoromethyl)-5-iodo-6-methylpyridine.
What is the SMILES notation for 3-chloro-2-(difluoromethyl)-5-iodo-6-methylpyridine?
The canonical SMILES for 3-chloro-2-(difluoromethyl)-5-iodo-6-methylpyridine is Cc1nc(C(F)F)c(Cl)cc1I.
What is the InChIKey of 3-chloro-2-(difluoromethyl)-5-iodo-6-methylpyridine?
The InChIKey is CCLLVOHRIMJOJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5ClF2IN/c1-3-5(11)2-4(8)6(12-3)7(9)10/h2,7H,1H3.
What are the key properties of 3-chloro-2-(difluoromethyl)-5-iodo-6-methylpyridine?
3-chloro-2-(difluoromethyl)-5-iodo-6-methylpyridine has a molecular weight of 303.48 g/mol, XLogP of 3.59, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-2-(difluoromethyl)-5-iodo-6-methylpyridine is sourced from PubChem (CID 130073015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).