gold(1+);5-(trifluoromethyl)-2H-pyridin-2-ide

C6H3AuF3N — CID 154239317

IUPACgold(1+);5-(trifluoromethyl)-2H-pyridin-2-ide
SMILESFC(F)(F)c1cc[c-]nc1.[Au+]
InChIInChI=1S/C6H3F3N.Au/c7-6(8,9)5-2-1-3-10-4-5;/h1-2,4H;/q-1;+1
InChIKeyXXXDRQQWHCYZBZ-UHFFFAOYSA-N
MW343.06 g/mol
LogP1.90
Rot. Bonds

About gold(1+);5-(trifluoromethyl)-2H-pyridin-2-ide

gold(1+);5-(trifluoromethyl)-2H-pyridin-2-ide (PubChem CID 154239317) has the molecular formula C6H3AuF3N and a molecular weight of 343.06 g/mol. Its IUPAC name is gold(1+);5-(trifluoromethyl)-2H-pyridin-2-ide.

Molecular Properties

Compound Namegold(1+);5-(trifluoromethyl)-2H-pyridin-2-ide
PubChem CID154239317
Molecular FormulaC6H3AuF3N
Molecular Weight343.06 g/mol
Exact Mass342.99
IUPAC Namegold(1+);5-(trifluoromethyl)-2H-pyridin-2-ide
SMILESFC(F)(F)c1cc[c-]nc1.[Au+]
InChIInChI=1S/C6H3F3N.Au/c7-6(8,9)5-2-1-3-10-4-5;/h1-2,4H;/q-1;+1
InChIKeyXXXDRQQWHCYZBZ-UHFFFAOYSA-N
XLogP1.90
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.06
LogP ≤ 51.90
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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Frequently Asked Questions

What is the IUPAC name of gold(1+);5-(trifluoromethyl)-2H-pyridin-2-ide?
The IUPAC name of gold(1+);5-(trifluoromethyl)-2H-pyridin-2-ide (CID 154239317) is gold(1+);5-(trifluoromethyl)-2H-pyridin-2-ide.
What is the SMILES notation for gold(1+);5-(trifluoromethyl)-2H-pyridin-2-ide?
The canonical SMILES for gold(1+);5-(trifluoromethyl)-2H-pyridin-2-ide is FC(F)(F)c1cc[c-]nc1.[Au+].
What is the InChIKey of gold(1+);5-(trifluoromethyl)-2H-pyridin-2-ide?
The InChIKey is XXXDRQQWHCYZBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H3F3N.Au/c7-6(8,9)5-2-1-3-10-4-5;/h1-2,4H;/q-1;+1.
What are the key properties of gold(1+);5-(trifluoromethyl)-2H-pyridin-2-ide?
gold(1+);5-(trifluoromethyl)-2H-pyridin-2-ide has a molecular weight of 343.06 g/mol, XLogP of 1.90, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for gold(1+);5-(trifluoromethyl)-2H-pyridin-2-ide is sourced from PubChem (CID 154239317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).