magnesium;hydride;6-(trifluoromethyl)-3H-pyridin-3-ide

C6H4F3MgN — CID 164988655

IUPACmagnesium;hydride;6-(trifluoromethyl)-3H-pyridin-3-ide
SMILESFC(F)(F)c1cc[c-]cn1.[H-].[Mg+2]
InChIInChI=1S/C6H3F3N.Mg.H/c7-6(8,9)5-3-1-2-4-10-5;;/h1,3-4H;;/q-1;+2;-1
InChIKeyOUPLUGZZPYMGQU-UHFFFAOYSA-N
MW171.40 g/mol
LogP1.63
Rot. Bonds

About magnesium;hydride;6-(trifluoromethyl)-3H-pyridin-3-ide

magnesium;hydride;6-(trifluoromethyl)-3H-pyridin-3-ide (PubChem CID 164988655) has the molecular formula C6H4F3MgN and a molecular weight of 171.40 g/mol. Its IUPAC name is magnesium;hydride;6-(trifluoromethyl)-3H-pyridin-3-ide.

Molecular Properties

Compound Namemagnesium;hydride;6-(trifluoromethyl)-3H-pyridin-3-ide
PubChem CID164988655
Molecular FormulaC6H4F3MgN
Molecular Weight171.40 g/mol
Exact Mass171.01
IUPAC Namemagnesium;hydride;6-(trifluoromethyl)-3H-pyridin-3-ide
SMILESFC(F)(F)c1cc[c-]cn1.[H-].[Mg+2]
InChIInChI=1S/C6H3F3N.Mg.H/c7-6(8,9)5-3-1-2-4-10-5;;/h1,3-4H;;/q-1;+2;-1
InChIKeyOUPLUGZZPYMGQU-UHFFFAOYSA-N
XLogP1.63
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.40
LogP ≤ 51.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2-methyl-5-(trifluoromethyl)-3H-pyridin-3-ide;uranium
CID 59045579
lithium;6-(trifluoromethyl)-3H-pyridin-3-ide
CID 85867280
lithium;6-(difluoromethyl)-3H-pyridin-3-ide
CID 85959934
(6-(Trifluoromethyl)pyridin-3-yl)magnesium bromide
CID 87081200
(3Z)-N-ethenyl-1,1,1-trifluorohexa-3,5-dien-2-imine
CID 134532241
magnesium;5-(trifluoromethyl)-2H-pyridin-2-ide;chloride
CID 140876190
magnesium;2-(trifluoromethyl)-4H-pyridin-4-ide;chloride
CID 146867926
magnesium;6-(trifluoromethyl)-3H-pyridin-3-ide;chloride
CID 152035450
6-(Trifluoromethyl)-2,3-dihydropyridine
CID 153700013
dioxotechnetium(1+);6-(trifluoromethyl)-3H-pyridin-3-ide
CID 162601299
2-(trifluoromethyl)-4H-pyridin-4-ide;uranium
CID 163475299
methylideneosmium;5-(trifluoromethyl)-2H-pyridin-2-ide
CID 163707204

Frequently Asked Questions

What is the IUPAC name of magnesium;hydride;6-(trifluoromethyl)-3H-pyridin-3-ide?
The IUPAC name of magnesium;hydride;6-(trifluoromethyl)-3H-pyridin-3-ide (CID 164988655) is magnesium;hydride;6-(trifluoromethyl)-3H-pyridin-3-ide.
What is the SMILES notation for magnesium;hydride;6-(trifluoromethyl)-3H-pyridin-3-ide?
The canonical SMILES for magnesium;hydride;6-(trifluoromethyl)-3H-pyridin-3-ide is FC(F)(F)c1cc[c-]cn1.[H-].[Mg+2].
What is the InChIKey of magnesium;hydride;6-(trifluoromethyl)-3H-pyridin-3-ide?
The InChIKey is OUPLUGZZPYMGQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H3F3N.Mg.H/c7-6(8,9)5-3-1-2-4-10-5;;/h1,3-4H;;/q-1;+2;-1.
What are the key properties of magnesium;hydride;6-(trifluoromethyl)-3H-pyridin-3-ide?
magnesium;hydride;6-(trifluoromethyl)-3H-pyridin-3-ide has a molecular weight of 171.40 g/mol, XLogP of 1.63, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for magnesium;hydride;6-(trifluoromethyl)-3H-pyridin-3-ide is sourced from PubChem (CID 164988655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).