platinum(2+);2-[2,3,4-tris(trifluoromethyl)benzene-6-id-1-yl]-6-[2-[6-[2,3,4-tris(trifluoromethyl)benzene-6-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine

C31H14F18N2Pt — CID 59342050

IUPACplatinum(2+);2-[2,3,4-tris(trifluoromethyl)benzene-6-id-1-yl]-6-[2-[6-[2,3,4-tris(trifluoromethyl)benzene-6-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine
SMILESCC(C)(c1cccc(-c2[c-]cc(C(F)(F)F)c(C(F)(F)F)c2C(F)(F)F)n1)c1cccc(-c2[c-]cc(C(F)(F)F)c(C(F)(F)F)c2C(F)(F)F)n1.[Pt+2]
InChIInChI=1S/C31H14F18N2.Pt/c1-25(2,19-7-3-5-17(50-19)13-9-11-15(26(32,33)34)23(30(44,45)46)21(13)28(38,39)40)20-8-4-6-18(51-20)14-10-12-16(27(35,36)37)24(31(47,48)49)22(14)29(41,42)43;/h3-8,11-12H,1-2H3;/q-2;+2
InChIKeyNUECYLUQLUMASX-UHFFFAOYSA-N
MW951.51 g/mol
LogP11.85
Rot. Bonds4

About platinum(2+);2-[2,3,4-tris(trifluoromethyl)benzene-6-id-1-yl]-6-[2-[6-[2,3,4-tris(trifluoromethyl)benzene-6-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine

platinum(2+);2-[2,3,4-tris(trifluoromethyl)benzene-6-id-1-yl]-6-[2-[6-[2,3,4-tris(trifluoromethyl)benzene-6-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine (PubChem CID 59342050) has the molecular formula C31H14F18N2Pt and a molecular weight of 951.51 g/mol. Its IUPAC name is platinum(2+);2-[2,3,4-tris(trifluoromethyl)benzene-6-id-1-yl]-6-[2-[6-[2,3,4-tris(trifluoromethyl)benzene-6-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine.

Molecular Properties

Compound Nameplatinum(2+);2-[2,3,4-tris(trifluoromethyl)benzene-6-id-1-yl]-6-[2-[6-[2,3,4-tris(trifluoromethyl)benzene-6-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine
PubChem CID59342050
Molecular FormulaC31H14F18N2Pt
Molecular Weight951.51 g/mol
Exact Mass951.05
IUPAC Nameplatinum(2+);2-[2,3,4-tris(trifluoromethyl)benzene-6-id-1-yl]-6-[2-[6-[2,3,4-tris(trifluoromethyl)benzene-6-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine
SMILESCC(C)(c1cccc(-c2[c-]cc(C(F)(F)F)c(C(F)(F)F)c2C(F)(F)F)n1)c1cccc(-c2[c-]cc(C(F)(F)F)c(C(F)(F)F)c2C(F)(F)F)n1.[Pt+2]
InChIInChI=1S/C31H14F18N2.Pt/c1-25(2,19-7-3-5-17(50-19)13-9-11-15(26(32,33)34)23(30(44,45)46)21(13)28(38,39)40)20-8-4-6-18(51-20)14-10-12-16(27(35,36)37)24(31(47,48)49)22(14)29(41,42)43;/h3-8,11-12H,1-2H3;/q-2;+2
InChIKeyNUECYLUQLUMASX-UHFFFAOYSA-N
XLogP11.85
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms52
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500951.51
LogP ≤ 511.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze platinum(2+);2-[2,3,4-tris(trifluoromethyl)benzene-6-id-1-yl]-6-[2-[6-[2,3,4-tris(trifluoromethyl)benzene-6-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine with MolForge

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Related Compounds

2-[1-methyl-5-(trifluoromethyl)-3H-pyrrol-3-id-2-yl]-6-[2-[6-[1-methyl-5-(trifluoromethyl)-3H-pyrrol-3-id-2-yl]-2-pyridinyl]propan-2-yl]pyridine;platinum(2+)
CID 57589546
2-[1-phenyl-1-[6-[1-phenyl-5-(trifluoromethyl)-3H-pyrazol-3-id-4-yl]-2-pyridinyl]ethyl]-6-[1-phenyl-5-(trifluoromethyl)-3H-pyrazol-3-id-4-yl]pyridine;platinum(2+)
CID 57589570
2-(2,4-Difluorobenzene-6-id-1-yl)-6-[2-[6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]propan-2-yl]pyridine;platinum(2+)
CID 57603959
2,6-difluoro-3-[4-fluoro-6-[2-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-2-pyridinyl]-4H-pyridin-4-ide;platinum(2+)
CID 57604023
2-(2,4-difluorobenzene-6-id-1-yl)-4-fluoro-6-[2-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine;platinum(2+)
CID 57604032
2-(2,4-difluoro-3-isocyanobenzene-6-id-1-yl)-6-[2-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine;platinum(2+)
CID 57604039
2,6-difluoro-3-[6-[2-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-2-pyridinyl]-4H-pyridin-4-ide;platinum(2+)
CID 57604064
2-[2-[6-(2,4-difluorobenzene-6-id-1-yl)-2-pyridinyl]propan-2-yl]-4-fluoro-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridine;platinum(2+)
CID 57604088
2-(2,4-difluorobenzene-6-id-1-yl)-6-[2-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine;platinum(2+)
CID 57604174
CID 57615577
CID 57615577
platinum(2+);2-(trifluoromethyl)-5-[6-[2-[6-[6-(trifluoromethyl)-4H-pyridin-4-id-3-yl]-2-pyridinyl]propan-2-yl]-2-pyridinyl]-4H-pyridin-4-ide
CID 57615604
3-[6-[2-[6-[2,6-bis(trifluoromethoxy)-4H-pyridin-4-id-3-yl]-2-pyridinyl]propan-2-yl]-2-pyridinyl]-2,6-bis(trifluoromethoxy)-4H-pyridin-4-ide;platinum(2+)
CID 57615643

Frequently Asked Questions

What is the IUPAC name of platinum(2+);2-[2,3,4-tris(trifluoromethyl)benzene-6-id-1-yl]-6-[2-[6-[2,3,4-tris(trifluoromethyl)benzene-6-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine?
The IUPAC name of platinum(2+);2-[2,3,4-tris(trifluoromethyl)benzene-6-id-1-yl]-6-[2-[6-[2,3,4-tris(trifluoromethyl)benzene-6-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine (CID 59342050) is platinum(2+);2-[2,3,4-tris(trifluoromethyl)benzene-6-id-1-yl]-6-[2-[6-[2,3,4-tris(trifluoromethyl)benzene-6-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine.
What is the SMILES notation for platinum(2+);2-[2,3,4-tris(trifluoromethyl)benzene-6-id-1-yl]-6-[2-[6-[2,3,4-tris(trifluoromethyl)benzene-6-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine?
The canonical SMILES for platinum(2+);2-[2,3,4-tris(trifluoromethyl)benzene-6-id-1-yl]-6-[2-[6-[2,3,4-tris(trifluoromethyl)benzene-6-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine is CC(C)(c1cccc(-c2[c-]cc(C(F)(F)F)c(C(F)(F)F)c2C(F)(F)F)n1)c1cccc(-c2[c-]cc(C(F)(F)F)c(C(F)(F)F)c2C(F)(F)F)n1.[Pt+2].
What is the InChIKey of platinum(2+);2-[2,3,4-tris(trifluoromethyl)benzene-6-id-1-yl]-6-[2-[6-[2,3,4-tris(trifluoromethyl)benzene-6-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine?
The InChIKey is NUECYLUQLUMASX-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H14F18N2.Pt/c1-25(2,19-7-3-5-17(50-19)13-9-11-15(26(32,33)34)23(30(44,45)46)21(13)28(38,39)40)20-8-4-6-18(51-20)14-10-12-16(27(35,36)37)24(31(47,48)49)22(14)29(41,42)43;/h3-8,11-12H,1-2H3;/q-2;+2.
What are the key properties of platinum(2+);2-[2,3,4-tris(trifluoromethyl)benzene-6-id-1-yl]-6-[2-[6-[2,3,4-tris(trifluoromethyl)benzene-6-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine?
platinum(2+);2-[2,3,4-tris(trifluoromethyl)benzene-6-id-1-yl]-6-[2-[6-[2,3,4-tris(trifluoromethyl)benzene-6-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine has a molecular weight of 951.51 g/mol, XLogP of 11.85, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for platinum(2+);2-[2,3,4-tris(trifluoromethyl)benzene-6-id-1-yl]-6-[2-[6-[2,3,4-tris(trifluoromethyl)benzene-6-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine is sourced from PubChem (CID 59342050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).