ruthenium;2-[5-(trifluoromethyl)-1H-pyrazol-3-yl]pyridine

C9H6F3N3Ru — CID 158678691

IUPACruthenium;2-[5-(trifluoromethyl)-1H-pyrazol-3-yl]pyridine
SMILESFC(F)(F)c1cc(-c2ccccn2)n[nH]1.[Ru]
InChIInChI=1S/C9H6F3N3.Ru/c10-9(11,12)8-5-7(14-15-8)6-3-1-2-4-13-6;/h1-5H,(H,14,15);
InChIKeyIEVOGRKARBAFJY-UHFFFAOYSA-N
MW314.23 g/mol
LogP2.49
Rot. Bonds1

About ruthenium;2-[5-(trifluoromethyl)-1H-pyrazol-3-yl]pyridine

ruthenium;2-[5-(trifluoromethyl)-1H-pyrazol-3-yl]pyridine (PubChem CID 158678691) has the molecular formula C9H6F3N3Ru and a molecular weight of 314.23 g/mol. Its IUPAC name is ruthenium;2-[5-(trifluoromethyl)-1H-pyrazol-3-yl]pyridine.

Molecular Properties

Compound Nameruthenium;2-[5-(trifluoromethyl)-1H-pyrazol-3-yl]pyridine
PubChem CID158678691
Molecular FormulaC9H6F3N3Ru
Molecular Weight314.23 g/mol
Exact Mass314.96
IUPAC Nameruthenium;2-[5-(trifluoromethyl)-1H-pyrazol-3-yl]pyridine
SMILESFC(F)(F)c1cc(-c2ccccn2)n[nH]1.[Ru]
InChIInChI=1S/C9H6F3N3.Ru/c10-9(11,12)8-5-7(14-15-8)6-3-1-2-4-13-6;/h1-5H,(H,14,15);
InChIKeyIEVOGRKARBAFJY-UHFFFAOYSA-N
XLogP2.49
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.23
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2,4-difluorophenyl)pyridine;ruthenium;bis(2-[5-(trifluoromethyl)-1H-pyrazol-3-yl]pyridine)
CID 161496314
dimethyl(phenyl)phosphane;osmium;bis(2-[5-(trifluoromethyl)-1H-pyrazol-3-yl]pyridine)
CID 175190624
4-pyridin-2-yl-6-(trifluoromethyl)-1H-pyrimidin-2-one
CID 113241920
tris(2-pyridin-2-ylpyridine);ruthenium
CID 6100643
bis(2-pyridin-2-ylpyridine);ruthenium
CID 87118114
iridium;2-pyridin-2-ylpyridine;ruthenium
CID 174707743
2-pyridin-2-yl-6-(trifluoromethyl)pyridine
CID 72771068
CID 154704206
CID 154704206
[2-[(2,4-difluorophenyl)methyl]phenyl]-phenylphosphinic acid;iridium;bis(2-[5-(trifluoromethyl)-1H-pyrazol-3-yl]pyridine)
CID 160547510
nickel;tris(2-pyridin-2-ylpyridine)
CID 76737267
2-pyridin-2-ylpyridine;dihydroiodide
CID 173445353
2-pyridin-2-ylpyridine;hydroiodide
CID 172833113

Frequently Asked Questions

What is the IUPAC name of ruthenium;2-[5-(trifluoromethyl)-1H-pyrazol-3-yl]pyridine?
The IUPAC name of ruthenium;2-[5-(trifluoromethyl)-1H-pyrazol-3-yl]pyridine (CID 158678691) is ruthenium;2-[5-(trifluoromethyl)-1H-pyrazol-3-yl]pyridine.
What is the SMILES notation for ruthenium;2-[5-(trifluoromethyl)-1H-pyrazol-3-yl]pyridine?
The canonical SMILES for ruthenium;2-[5-(trifluoromethyl)-1H-pyrazol-3-yl]pyridine is FC(F)(F)c1cc(-c2ccccn2)n[nH]1.[Ru].
What is the InChIKey of ruthenium;2-[5-(trifluoromethyl)-1H-pyrazol-3-yl]pyridine?
The InChIKey is IEVOGRKARBAFJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H6F3N3.Ru/c10-9(11,12)8-5-7(14-15-8)6-3-1-2-4-13-6;/h1-5H,(H,14,15);.
What are the key properties of ruthenium;2-[5-(trifluoromethyl)-1H-pyrazol-3-yl]pyridine?
ruthenium;2-[5-(trifluoromethyl)-1H-pyrazol-3-yl]pyridine has a molecular weight of 314.23 g/mol, XLogP of 2.49, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ruthenium;2-[5-(trifluoromethyl)-1H-pyrazol-3-yl]pyridine is sourced from PubChem (CID 158678691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).