6-(fluoromethyl)-3-iodo-2-(trifluoromethyl)pyridine

C7H4F4IN — CID 130952875

IUPAC6-(fluoromethyl)-3-iodo-2-(trifluoromethyl)pyridine
SMILESFCc1ccc(I)c(C(F)(F)F)n1
InChIInChI=1S/C7H4F4IN/c8-3-4-1-2-5(12)6(13-4)7(9,10)11/h1-2H,3H2
InChIKeyNZUCTMCBWWBPRS-UHFFFAOYSA-N
MW305.01 g/mol
LogP3.17
Rot. Bonds1

About 6-(fluoromethyl)-3-iodo-2-(trifluoromethyl)pyridine

6-(fluoromethyl)-3-iodo-2-(trifluoromethyl)pyridine (PubChem CID 130952875) has the molecular formula C7H4F4IN and a molecular weight of 305.01 g/mol. Its IUPAC name is 6-(fluoromethyl)-3-iodo-2-(trifluoromethyl)pyridine.

Molecular Properties

Compound Name6-(fluoromethyl)-3-iodo-2-(trifluoromethyl)pyridine
PubChem CID130952875
Molecular FormulaC7H4F4IN
Molecular Weight305.01 g/mol
Exact Mass304.93
IUPAC Name6-(fluoromethyl)-3-iodo-2-(trifluoromethyl)pyridine
SMILESFCc1ccc(I)c(C(F)(F)F)n1
InChIInChI=1S/C7H4F4IN/c8-3-4-1-2-5(12)6(13-4)7(9,10)11/h1-2H,3H2
InChIKeyNZUCTMCBWWBPRS-UHFFFAOYSA-N
XLogP3.17
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.01
LogP ≤ 53.17
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

ethyl 2-[5-iodo-6-(trifluoromethyl)-2-pyridinyl]acetate
CID 133096647
5-iodo-6-(trifluoromethyl)pyridine-2-carboxylic acid
CID 130851869
3-iodo-6-(2,4,6-trichlorophenyl)-2-(trifluoromethyl)pyridine
CID 134636359
3-iodo-6-(2,4,5-trichlorophenyl)-2-(trifluoromethyl)pyridine
CID 134626981
methyl 5-iodo-6-(trifluoromethyl)pyridine-2-carboxylate
CID 131297984
2-(fluoromethyl)-6-iodo-4-(trifluoromethyl)pyridine
CID 130967564
3-fluoro-6-(fluoromethyl)-4-(trifluoromethoxy)-2-(trifluoromethyl)pyridine
CID 134680375
3-iodo-6-(trifluoromethyl)pyridine-2-carbonyl chloride
CID 130983719
[4-iodo-3-(trifluoromethyl)phenyl]methanamine
CID 53414331
3-(fluoromethyl)-6-methyl-2-(trifluoromethyl)pyridine
CID 153337824
2-ethoxy-3-iodo-6-(trifluoromethyl)pyridine
CID 131118413
6-(bromomethyl)-2-iodo-3-(trifluoromethyl)pyridine
CID 131074199

Frequently Asked Questions

What is the IUPAC name of 6-(fluoromethyl)-3-iodo-2-(trifluoromethyl)pyridine?
The IUPAC name of 6-(fluoromethyl)-3-iodo-2-(trifluoromethyl)pyridine (CID 130952875) is 6-(fluoromethyl)-3-iodo-2-(trifluoromethyl)pyridine.
What is the SMILES notation for 6-(fluoromethyl)-3-iodo-2-(trifluoromethyl)pyridine?
The canonical SMILES for 6-(fluoromethyl)-3-iodo-2-(trifluoromethyl)pyridine is FCc1ccc(I)c(C(F)(F)F)n1.
What is the InChIKey of 6-(fluoromethyl)-3-iodo-2-(trifluoromethyl)pyridine?
The InChIKey is NZUCTMCBWWBPRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H4F4IN/c8-3-4-1-2-5(12)6(13-4)7(9,10)11/h1-2H,3H2.
What are the key properties of 6-(fluoromethyl)-3-iodo-2-(trifluoromethyl)pyridine?
6-(fluoromethyl)-3-iodo-2-(trifluoromethyl)pyridine has a molecular weight of 305.01 g/mol, XLogP of 3.17, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(fluoromethyl)-3-iodo-2-(trifluoromethyl)pyridine is sourced from PubChem (CID 130952875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).