platinum(2+);2-pyridin-2-ylpyridine;bis(3-(trifluoromethyl)pyrazol-1-ide)

C18H12F6N6Pt — CID 58711211

IUPACplatinum(2+);2-pyridin-2-ylpyridine;bis(3-(trifluoromethyl)pyrazol-1-ide)
SMILESFC(F)(F)c1cc[n-]n1.FC(F)(F)c1cc[n-]n1.[Pt+2].c1ccc(-c2ccccn2)nc1
InChIInChI=1S/C10H8N2.2C4H2F3N2.Pt/c1-3-7-11-9(5-1)10-6-2-4-8-12-10;2*5-4(6,7)3-1-2-8-9-3;/h1-8H;2*1-2H;/q;2*-1;+2
InChIKeyWOLSKEJNKNLAHK-UHFFFAOYSA-N
MW621.40 g/mol
LogP4.26
Rot. Bonds1

About platinum(2+);2-pyridin-2-ylpyridine;bis(3-(trifluoromethyl)pyrazol-1-ide)

platinum(2+);2-pyridin-2-ylpyridine;bis(3-(trifluoromethyl)pyrazol-1-ide) (PubChem CID 58711211) has the molecular formula C18H12F6N6Pt and a molecular weight of 621.40 g/mol. Its IUPAC name is platinum(2+);2-pyridin-2-ylpyridine;bis(3-(trifluoromethyl)pyrazol-1-ide).

Molecular Properties

Compound Nameplatinum(2+);2-pyridin-2-ylpyridine;bis(3-(trifluoromethyl)pyrazol-1-ide)
PubChem CID58711211
Molecular FormulaC18H12F6N6Pt
Molecular Weight621.40 g/mol
Exact Mass621.07
IUPAC Nameplatinum(2+);2-pyridin-2-ylpyridine;bis(3-(trifluoromethyl)pyrazol-1-ide)
SMILESFC(F)(F)c1cc[n-]n1.FC(F)(F)c1cc[n-]n1.[Pt+2].c1ccc(-c2ccccn2)nc1
InChIInChI=1S/C10H8N2.2C4H2F3N2.Pt/c1-3-7-11-9(5-1)10-6-2-4-8-12-10;2*5-4(6,7)3-1-2-8-9-3;/h1-8H;2*1-2H;/q;2*-1;+2
InChIKeyWOLSKEJNKNLAHK-UHFFFAOYSA-N
XLogP4.26
TPSA79.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500621.40
LogP ≤ 54.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-Pyridin-2-yl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine
CID 53391873
6-(3,5-Dimethyltriazol-4-yl)-1-[(1,4,4-trifluorocyclohexyl)methyl]-3-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]pyrrolo[3,2-b]pyridine
CID 90426828
1-[(4,4-Difluorocyclohexyl)methyl]-6-(3,5-dimethyltriazol-4-yl)-3-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]pyrrolo[3,2-b]pyridine
CID 118059767
US20230339900, Example 2
CID 162760946
3-[2-Fluoro-5-(trifluoromethyl)phenyl]-1-(pyrazin-2-ylmethyl)pyrazolo[4,3-b]pyridine
CID 134611935
2-[1-[4-[3,5-Bis(trifluoromethyl)pyrazol-1-yl]phenyl]triazol-4-yl]pyridine
CID 132212053
3-[4-[4-[3,5-Bis(trifluoromethyl)pyrazol-1-yl]phenyl]triazol-1-yl]pyridine
CID 132224407
4-[4-[4-[3,5-Bis(trifluoromethyl)pyrazol-1-yl]phenyl]triazol-1-yl]pyridine
CID 132224411
4-[4-[4-[3,5-Bis(trifluoromethyl)pyrazol-1-yl]phenyl]triazol-1-yl]-3-fluoropyridine
CID 132224413
US11530210, Example 176
CID 155388707
US11530210, Example 175
CID 155388792
2-[5-(5-pyridin-2-yl-1H-pyrazol-3-yl)-2H-pyrazol-3-yl]pyridine
CID 340685

Frequently Asked Questions

What is the IUPAC name of platinum(2+);2-pyridin-2-ylpyridine;bis(3-(trifluoromethyl)pyrazol-1-ide)?
The IUPAC name of platinum(2+);2-pyridin-2-ylpyridine;bis(3-(trifluoromethyl)pyrazol-1-ide) (CID 58711211) is platinum(2+);2-pyridin-2-ylpyridine;bis(3-(trifluoromethyl)pyrazol-1-ide).
What is the SMILES notation for platinum(2+);2-pyridin-2-ylpyridine;bis(3-(trifluoromethyl)pyrazol-1-ide)?
The canonical SMILES for platinum(2+);2-pyridin-2-ylpyridine;bis(3-(trifluoromethyl)pyrazol-1-ide) is FC(F)(F)c1cc[n-]n1.FC(F)(F)c1cc[n-]n1.[Pt+2].c1ccc(-c2ccccn2)nc1.
What is the InChIKey of platinum(2+);2-pyridin-2-ylpyridine;bis(3-(trifluoromethyl)pyrazol-1-ide)?
The InChIKey is WOLSKEJNKNLAHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8N2.2C4H2F3N2.Pt/c1-3-7-11-9(5-1)10-6-2-4-8-12-10;2*5-4(6,7)3-1-2-8-9-3;/h1-8H;2*1-2H;/q;2*-1;+2.
What are the key properties of platinum(2+);2-pyridin-2-ylpyridine;bis(3-(trifluoromethyl)pyrazol-1-ide)?
platinum(2+);2-pyridin-2-ylpyridine;bis(3-(trifluoromethyl)pyrazol-1-ide) has a molecular weight of 621.40 g/mol, XLogP of 4.26, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for platinum(2+);2-pyridin-2-ylpyridine;bis(3-(trifluoromethyl)pyrazol-1-ide) is sourced from PubChem (CID 58711211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).