iodozinc(1+);6-(trifluoromethyl)-2H-pyridin-2-ide

C6H3F3INZn — CID 146002555

IUPACiodozinc(1+);6-(trifluoromethyl)-2H-pyridin-2-ide
SMILESFC(F)(F)c1ccc[c-]n1.[Zn+]I
InChIInChI=1S/C6H3F3N.HI.Zn/c7-6(8,9)5-3-1-2-4-10-5;;/h1-3H;1H;/q-1;;+2/p-1
InChIKeyMVQLNYHRJJREOV-UHFFFAOYSA-M
MW338.39 g/mol
LogP2.78
Rot. Bonds

About iodozinc(1+);6-(trifluoromethyl)-2H-pyridin-2-ide

iodozinc(1+);6-(trifluoromethyl)-2H-pyridin-2-ide (PubChem CID 146002555) has the molecular formula C6H3F3INZn and a molecular weight of 338.39 g/mol. Its IUPAC name is iodozinc(1+);6-(trifluoromethyl)-2H-pyridin-2-ide.

Molecular Properties

Compound Nameiodozinc(1+);6-(trifluoromethyl)-2H-pyridin-2-ide
PubChem CID146002555
Molecular FormulaC6H3F3INZn
Molecular Weight338.39 g/mol
Exact Mass336.86
IUPAC Nameiodozinc(1+);6-(trifluoromethyl)-2H-pyridin-2-ide
SMILESFC(F)(F)c1ccc[c-]n1.[Zn+]I
InChIInChI=1S/C6H3F3N.HI.Zn/c7-6(8,9)5-3-1-2-4-10-5;;/h1-3H;1H;/q-1;;+2/p-1
InChIKeyMVQLNYHRJJREOV-UHFFFAOYSA-M
XLogP2.78
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.39
LogP ≤ 52.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

6-(trifluoromethyl)pyridine-2-carbonyl fluoride
CID 174756442
ethane;2-methyl-6-(trifluoromethyl)pyridine
CID 144746626
5-deuterio-2-(trifluoromethyl)pyridine
CID 142788130
5-chloro-2-hydroxy-N-[2-(trifluoromethyl)-4-pyridinyl]benzamide
CID 168876082
6-(trifluoromethyl)-1,2,4-triazine
CID 90993457
[6-(trifluoromethyl)-2-pyridinyl]methanediamine
CID 135243406
2-fluoro-3,6-bis(trifluoromethyl)pyridine
CID 133095208
difluoro(pyridin-2-yl)methanamine
CID 83854913
trifluoromethylbenzene;zinc;hydrochloride
CID 87245768
2-iodo-6-(trifluoromethyl)pyridine-3-carbaldehyde
CID 130922748
7-chloro-2-(trifluoromethyl)quinoline
CID 11031724
4-deuterio-2,6-bis(trifluoromethyl)pyridine
CID 175919403

Frequently Asked Questions

What is the IUPAC name of iodozinc(1+);6-(trifluoromethyl)-2H-pyridin-2-ide?
The IUPAC name of iodozinc(1+);6-(trifluoromethyl)-2H-pyridin-2-ide (CID 146002555) is iodozinc(1+);6-(trifluoromethyl)-2H-pyridin-2-ide.
What is the SMILES notation for iodozinc(1+);6-(trifluoromethyl)-2H-pyridin-2-ide?
The canonical SMILES for iodozinc(1+);6-(trifluoromethyl)-2H-pyridin-2-ide is FC(F)(F)c1ccc[c-]n1.[Zn+]I.
What is the InChIKey of iodozinc(1+);6-(trifluoromethyl)-2H-pyridin-2-ide?
The InChIKey is MVQLNYHRJJREOV-UHFFFAOYSA-M. The full InChI is InChI=1S/C6H3F3N.HI.Zn/c7-6(8,9)5-3-1-2-4-10-5;;/h1-3H;1H;/q-1;;+2/p-1.
What are the key properties of iodozinc(1+);6-(trifluoromethyl)-2H-pyridin-2-ide?
iodozinc(1+);6-(trifluoromethyl)-2H-pyridin-2-ide has a molecular weight of 338.39 g/mol, XLogP of 2.78, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for iodozinc(1+);6-(trifluoromethyl)-2H-pyridin-2-ide is sourced from PubChem (CID 146002555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).