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

C7H3F5IN — CID 130096769

IUPAC6-(difluoromethyl)-2-iodo-3-(trifluoromethyl)pyridine
SMILESFC(F)c1ccc(C(F)(F)F)c(I)n1
InChIInChI=1S/C7H3F5IN/c8-5(9)4-2-1-3(6(13)14-4)7(10,11)12/h1-2,5H
InChIKeyVDCQFBKMXPNNJU-UHFFFAOYSA-N
MW323.00 g/mol
LogP3.64
Rot. Bonds1

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

6-(difluoromethyl)-2-iodo-3-(trifluoromethyl)pyridine (PubChem CID 130096769) has the molecular formula C7H3F5IN and a molecular weight of 323.00 g/mol. Its IUPAC name is 6-(difluoromethyl)-2-iodo-3-(trifluoromethyl)pyridine.

Molecular Properties

Compound Name6-(difluoromethyl)-2-iodo-3-(trifluoromethyl)pyridine
PubChem CID130096769
Molecular FormulaC7H3F5IN
Molecular Weight323.00 g/mol
Exact Mass322.92
IUPAC Name6-(difluoromethyl)-2-iodo-3-(trifluoromethyl)pyridine
SMILESFC(F)c1ccc(C(F)(F)F)c(I)n1
InChIInChI=1S/C7H3F5IN/c8-5(9)4-2-1-3(6(13)14-4)7(10,11)12/h1-2,5H
InChIKeyVDCQFBKMXPNNJU-UHFFFAOYSA-N
XLogP3.64
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.00
LogP ≤ 53.64
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

[6-(difluoromethyl)-2-iodo-4-(trifluoromethyl)-3-pyridinyl]methanol
CID 130087693
6-(difluoromethyl)-2-iodo-4-(trifluoromethyl)pyridine-3-carbonitrile
CID 130077456
6-(bromomethyl)-2-iodo-3-(trifluoromethyl)pyridine
CID 131074199
6-(difluoromethyl)-2-iodopyridine-3-carbonitrile
CID 130095815
2-(difluoromethyl)-6-iodo-5-(trifluoromethyl)pyridin-3-ol
CID 118825956
2-chloro-3-(difluoromethyl)-6-iodo-5-(trifluoromethyl)pyridine
CID 119007178
6-(difluoromethyl)-2-(trifluoromethyl)pyridin-3-amine
CID 130094791
6-(difluoromethyl)-3-fluoro-4-(trifluoromethyl)pyridin-2-amine
CID 119007069
6-(difluoromethyl)-2-iodo-4-(trifluoromethoxy)-3-(trifluoromethyl)pyridine
CID 134681331
6-(difluoromethyl)-3-iodo-4-(trifluoromethyl)pyridine-2-carbaldehyde
CID 130087725
methyl 2-[6-(difluoromethyl)-2-iodo-4-(trifluoromethyl)-3-pyridinyl]acetate
CID 133100700
5-(difluoromethyl)-6-iodo-3-(trifluoromethyl)pyridin-2-amine
CID 118999966

Frequently Asked Questions

What is the IUPAC name of 6-(difluoromethyl)-2-iodo-3-(trifluoromethyl)pyridine?
The IUPAC name of 6-(difluoromethyl)-2-iodo-3-(trifluoromethyl)pyridine (CID 130096769) is 6-(difluoromethyl)-2-iodo-3-(trifluoromethyl)pyridine.
What is the SMILES notation for 6-(difluoromethyl)-2-iodo-3-(trifluoromethyl)pyridine?
The canonical SMILES for 6-(difluoromethyl)-2-iodo-3-(trifluoromethyl)pyridine is FC(F)c1ccc(C(F)(F)F)c(I)n1.
What is the InChIKey of 6-(difluoromethyl)-2-iodo-3-(trifluoromethyl)pyridine?
The InChIKey is VDCQFBKMXPNNJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H3F5IN/c8-5(9)4-2-1-3(6(13)14-4)7(10,11)12/h1-2,5H.
What are the key properties of 6-(difluoromethyl)-2-iodo-3-(trifluoromethyl)pyridine?
6-(difluoromethyl)-2-iodo-3-(trifluoromethyl)pyridine has a molecular weight of 323.00 g/mol, XLogP of 3.64, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(difluoromethyl)-2-iodo-3-(trifluoromethyl)pyridine is sourced from PubChem (CID 130096769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).