2-(3-tert-butyl-5H-pyrazol-5-id-1-yl)-6-[2-[6-(3-tert-butyl-5H-pyrazol-5-id-1-yl)-2-pyridinyl]ethyl]pyridine;2-[diphenyl-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]methyl]-6-(3-methyl-5H-pyrazol-5-id-1-yl)pyridine;1-[6-[[6-(3-isocyano-5H-pyrazol-5-id-1-yl)-2-pyridinyl]oxy]-2-pyridinyl]-5H-pyrazol-5-ide-3-carbonitrile;2-(3-methyl-5H-pyrazol-5-id-1-yl)-6-[9-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]fluoren-9-yl]pyridine;2-(3-methyl-5H-pyrazol-5-id-1-yl)-6-[[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]sulfanyl]pyridine;pentakis(platinum(2+))

C124H89F9N32OPt5S — CID 161283503

About 2-(3-tert-butyl-5H-pyrazol-5-id-1-yl)-6-[2-[6-(3-tert-butyl-5H-pyrazol-5-id-1-yl)-2-pyridinyl]ethyl]pyridine;2-[diphenyl-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]methyl]-6-(3-methyl-5H-pyrazol-5-id-1-yl)pyridine;1-[6-[[6-(3-isocyano-5H-pyrazol-5-id-1-yl)-2-pyridinyl]oxy]-2-pyridinyl]-5H-pyrazol-5-ide-3-carbonitrile;2-(3-methyl-5H-pyrazol-5-id-1-yl)-6-[9-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]fluoren-9-yl]pyridine;2-(3-methyl-5H-pyrazol-5-id-1-yl)-6-[[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]sulfanyl]pyridine;pentakis(platinum(2+))

2-(3-tert-butyl-5H-pyrazol-5-id-1-yl)-6-[2-[6-(3-tert-butyl-5H-pyrazol-5-id-1-yl)-2-pyridinyl]ethyl]pyridine;2-[diphenyl-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]methyl]-6-(3-methyl-5H-pyrazol-5-id-1-yl)pyridine;1-[6-[[6-(3-isocyano-5H-pyrazol-5-id-1-yl)-2-pyridinyl]oxy]-2-pyridinyl]-5H-pyrazol-5-ide-3-carbonitrile;2-(3-methyl-5H-pyrazol-5-id-1-yl)-6-[9-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]fluoren-9-yl]pyridine;2-(3-methyl-5H-pyrazol-5-id-1-yl)-6-[[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]sulfanyl]pyridine;pentakis(platinum(2+)) (PubChem CID 161283503) has the molecular formula C124H89F9N32OPt5S and a molecular weight of 3221.74 g/mol. Its IUPAC name is 2-(3-tert-butyl-5H-pyrazol-5-id-1-yl)-6-[2-[6-(3-tert-butyl-5H-pyrazol-5-id-1-yl)-2-pyridinyl]ethyl]pyridine;2-[diphenyl-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]methyl]-6-(3-methyl-5H-pyrazol-5-id-1-yl)pyridine;1-[6-[[6-(3-isocyano-5H-pyrazol-5-id-1-yl)-2-pyridinyl]oxy]-2-pyridinyl]-5H-pyrazol-5-ide-3-carbonitrile;2-(3-methyl-5H-pyrazol-5-id-1-yl)-6-[9-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]fluoren-9-yl]pyridine;2-(3-methyl-5H-pyrazol-5-id-1-yl)-6-[[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]sulfanyl]pyridine;pentakis(platinum(2+)).

Molecular Properties

• Compound Name: 2-(3-tert-butyl-5H-pyrazol-5-id-1-yl)-6-[2-[6-(3-tert-butyl-5H-pyrazol-5-id-1-yl)-2-pyridinyl]ethyl]pyridine;2-[diphenyl-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]methyl]-6-(3-methyl-5H-pyrazol-5-id-1-yl)pyridine;1-[6-[[6-(3-isocyano-5H-pyrazol-5-id-1-yl)-2-pyridinyl]oxy]-2-pyridinyl]-5H-pyrazol-5-ide-3-carbonitrile;2-(3-methyl-5H-pyrazol-5-id-1-yl)-6-[9-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]fluoren-9-yl]pyridine;2-(3-methyl-5H-pyrazol-5-id-1-yl)-6-[[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]sulfanyl]pyridine;pentakis(platinum(2+))
• PubChem CID: 161283503
• Molecular Formula: C124H89F9N32OPt5S
• Molecular Weight: 3221.74 g/mol
• Exact Mass: 3219.57
• IUPAC Name: 2-(3-tert-butyl-5H-pyrazol-5-id-1-yl)-6-[2-[6-(3-tert-butyl-5H-pyrazol-5-id-1-yl)-2-pyridinyl]ethyl]pyridine;2-[diphenyl-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]methyl]-6-(3-methyl-5H-pyrazol-5-id-1-yl)pyridine;1-[6-[[6-(3-isocyano-5H-pyrazol-5-id-1-yl)-2-pyridinyl]oxy]-2-pyridinyl]-5H-pyrazol-5-ide-3-carbonitrile;2-(3-methyl-5H-pyrazol-5-id-1-yl)-6-[9-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]fluoren-9-yl]pyridine;2-(3-methyl-5H-pyrazol-5-id-1-yl)-6-[[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]sulfanyl]pyridine;pentakis(platinum(2+))
• SMILES: CC(C)(C)c1c[c-]n(-c2cccc(CCc3cccc(-n4[c-]cc(C(C)(C)C)n4)n3)n2)n1.Cc1c[c-]n(-c2cccc(C(c3ccccc3)(c3ccccc3)c3cccc(-n4[c-]cc(C(F)(F)F)n4)n3)n2)n1.Cc1c[c-]n(-c2cccc(C3(c4cccc(-n5[c-]cc(C(F)(F)F)n5)n4)c4ccccc4-c4ccccc43)n2)n1.Cc1c[c-]n(-c2cccc(Sc3cccc(-n4[c-]cc(C(F)(F)F)n4)n3)n2)n1.[C-]#[N+]c1c[c-]n(-c2cccc(Oc3cccc(-n4[c-]cc(C#N)n4)n3)n2)n1.[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2]
• InChI: InChI=1S/C31H19F3N6.C31H21F3N6.C26H30N6.C18H11F3N6S.C18H8N8O.5Pt/c1-20-16-18-39(37-20)28-14-6-12-25(35-28)30(23-10-4-2-8-21(23)22-9-3-5-11-24(22)30)26-13-7-15-29(36-26)40-19-17-27(38-40)31(32,33)34;1-22-18-20-39(37-22)28-16-8-14-25(35-28)30(23-10-4-2-5-11-23,24-12-6-3-7-13-24)26-15-9-17-29(36-26)40-21-19-27(38-40)31(32,33)34;1-25(2,3)21-15-17-31(29-21)23-11-7-9-19(27-23)13-14-20-10-8-12-24(28-20)32-18-16-22(30-32)26(4,5)6;1-12-8-10-26(24-12)14-4-2-6-16(22-14)28-17-7-3-5-15(23-17)27-11-9-13(25-27)18(19,20)21;1-20-14-9-11-26(24-14)16-5-3-7-18(22-16)27-17-6-2-4-15(21-17)25-10-8-13(12-19)23-25;;;;;/h2-17H,1H3;2-19H,1H3;7-12,15-16H,13-14H2,1-6H3;2-9H,1H3;2-9H;;;;;/q5*-2;5*+2
• InChIKey: ZFIIJLBWFRUHJM-UHFFFAOYSA-N
• XLogP: 23.70
• TPSA: 344.48 Ų
• H-Bond Acceptors: 33
• Rotatable Bonds: 23
• Heavy Atoms: 172
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3221.74
LogP ≤ 5	23.70
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	33

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-(3-tert-butyl-5H-pyrazol-5-id-1-yl)-6-[2-[6-(3-tert-butyl-5H-pyrazol-5-id-1-yl)-2-pyridinyl]ethyl]pyridine;2-[diphenyl-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]methyl]-6-(3-methyl-5H-pyrazol-5-id-1-yl)pyridine;1-[6-[[6-(3-isocyano-5H-pyrazol-5-id-1-yl)-2-pyridinyl]oxy]-2-pyridinyl]-5H-pyrazol-5-ide-3-carbonitrile;2-(3-methyl-5H-pyrazol-5-id-1-yl)-6-[9-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]fluoren-9-yl]pyridine;2-(3-methyl-5H-pyrazol-5-id-1-yl)-6-[[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]sulfanyl]pyridine;pentakis(platinum(2+))?

The IUPAC name of 2-(3-tert-butyl-5H-pyrazol-5-id-1-yl)-6-[2-[6-(3-tert-butyl-5H-pyrazol-5-id-1-yl)-2-pyridinyl]ethyl]pyridine;2-[diphenyl-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]methyl]-6-(3-methyl-5H-pyrazol-5-id-1-yl)pyridine;1-[6-[[6-(3-isocyano-5H-pyrazol-5-id-1-yl)-2-pyridinyl]oxy]-2-pyridinyl]-5H-pyrazol-5-ide-3-carbonitrile;2-(3-methyl-5H-pyrazol-5-id-1-yl)-6-[9-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]fluoren-9-yl]pyridine;2-(3-methyl-5H-pyrazol-5-id-1-yl)-6-[[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]sulfanyl]pyridine;pentakis(platinum(2+)) (CID 161283503) is 2-(3-tert-butyl-5H-pyrazol-5-id-1-yl)-6-[2-[6-(3-tert-butyl-5H-pyrazol-5-id-1-yl)-2-pyridinyl]ethyl]pyridine;2-[diphenyl-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]methyl]-6-(3-methyl-5H-pyrazol-5-id-1-yl)pyridine;1-[6-[[6-(3-isocyano-5H-pyrazol-5-id-1-yl)-2-pyridinyl]oxy]-2-pyridinyl]-5H-pyrazol-5-ide-3-carbonitrile;2-(3-methyl-5H-pyrazol-5-id-1-yl)-6-[9-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]fluoren-9-yl]pyridine;2-(3-methyl-5H-pyrazol-5-id-1-yl)-6-[[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]sulfanyl]pyridine;pentakis(platinum(2+)).

What is the SMILES notation for 2-(3-tert-butyl-5H-pyrazol-5-id-1-yl)-6-[2-[6-(3-tert-butyl-5H-pyrazol-5-id-1-yl)-2-pyridinyl]ethyl]pyridine;2-[diphenyl-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]methyl]-6-(3-methyl-5H-pyrazol-5-id-1-yl)pyridine;1-[6-[[6-(3-isocyano-5H-pyrazol-5-id-1-yl)-2-pyridinyl]oxy]-2-pyridinyl]-5H-pyrazol-5-ide-3-carbonitrile;2-(3-methyl-5H-pyrazol-5-id-1-yl)-6-[9-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]fluoren-9-yl]pyridine;2-(3-methyl-5H-pyrazol-5-id-1-yl)-6-[[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]sulfanyl]pyridine;pentakis(platinum(2+))?

The canonical SMILES for 2-(3-tert-butyl-5H-pyrazol-5-id-1-yl)-6-[2-[6-(3-tert-butyl-5H-pyrazol-5-id-1-yl)-2-pyridinyl]ethyl]pyridine;2-[diphenyl-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]methyl]-6-(3-methyl-5H-pyrazol-5-id-1-yl)pyridine;1-[6-[[6-(3-isocyano-5H-pyrazol-5-id-1-yl)-2-pyridinyl]oxy]-2-pyridinyl]-5H-pyrazol-5-ide-3-carbonitrile;2-(3-methyl-5H-pyrazol-5-id-1-yl)-6-[9-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]fluoren-9-yl]pyridine;2-(3-methyl-5H-pyrazol-5-id-1-yl)-6-[[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]sulfanyl]pyridine;pentakis(platinum(2+)) is CC(C)(C)c1c[c-]n(-c2cccc(CCc3cccc(-n4[c-]cc(C(C)(C)C)n4)n3)n2)n1.Cc1c[c-]n(-c2cccc(C(c3ccccc3)(c3ccccc3)c3cccc(-n4[c-]cc(C(F)(F)F)n4)n3)n2)n1.Cc1c[c-]n(-c2cccc(C3(c4cccc(-n5[c-]cc(C(F)(F)F)n5)n4)c4ccccc4-c4ccccc43)n2)n1.Cc1c[c-]n(-c2cccc(Sc3cccc(-n4[c-]cc(C(F)(F)F)n4)n3)n2)n1.[C-]#[N+]c1c[c-]n(-c2cccc(Oc3cccc(-n4[c-]cc(C#N)n4)n3)n2)n1.[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2].

What is the InChIKey of 2-(3-tert-butyl-5H-pyrazol-5-id-1-yl)-6-[2-[6-(3-tert-butyl-5H-pyrazol-5-id-1-yl)-2-pyridinyl]ethyl]pyridine;2-[diphenyl-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]methyl]-6-(3-methyl-5H-pyrazol-5-id-1-yl)pyridine;1-[6-[[6-(3-isocyano-5H-pyrazol-5-id-1-yl)-2-pyridinyl]oxy]-2-pyridinyl]-5H-pyrazol-5-ide-3-carbonitrile;2-(3-methyl-5H-pyrazol-5-id-1-yl)-6-[9-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]fluoren-9-yl]pyridine;2-(3-methyl-5H-pyrazol-5-id-1-yl)-6-[[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]sulfanyl]pyridine;pentakis(platinum(2+))?

The InChIKey is ZFIIJLBWFRUHJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H19F3N6.C31H21F3N6.C26H30N6.C18H11F3N6S.C18H8N8O.5Pt/c1-20-16-18-39(37-20)28-14-6-12-25(35-28)30(23-10-4-2-8-21(23)22-9-3-5-11-24(22)30)26-13-7-15-29(36-26)40-19-17-27(38-40)31(32,33)34;1-22-18-20-39(37-22)28-16-8-14-25(35-28)30(23-10-4-2-5-11-23,24-12-6-3-7-13-24)26-15-9-17-29(36-26)40-21-19-27(38-40)31(32,33)34;1-25(2,3)21-15-17-31(29-21)23-11-7-9-19(27-23)13-14-20-10-8-12-24(28-20)32-18-16-22(30-32)26(4,5)6;1-12-8-10-26(24-12)14-4-2-6-16(22-14)28-17-7-3-5-15(23-17)27-11-9-13(25-27)18(19,20)21;1-20-14-9-11-26(24-14)16-5-3-7-18(22-16)27-17-6-2-4-15(21-17)25-10-8-13(12-19)23-25;;;;;/h2-17H,1H3;2-19H,1H3;7-12,15-16H,13-14H2,1-6H3;2-9H,1H3;2-9H;;;;;/q5*-2;5*+2.

What are the key properties of 2-(3-tert-butyl-5H-pyrazol-5-id-1-yl)-6-[2-[6-(3-tert-butyl-5H-pyrazol-5-id-1-yl)-2-pyridinyl]ethyl]pyridine;2-[diphenyl-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]methyl]-6-(3-methyl-5H-pyrazol-5-id-1-yl)pyridine;1-[6-[[6-(3-isocyano-5H-pyrazol-5-id-1-yl)-2-pyridinyl]oxy]-2-pyridinyl]-5H-pyrazol-5-ide-3-carbonitrile;2-(3-methyl-5H-pyrazol-5-id-1-yl)-6-[9-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]fluoren-9-yl]pyridine;2-(3-methyl-5H-pyrazol-5-id-1-yl)-6-[[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]sulfanyl]pyridine;pentakis(platinum(2+))?

2-(3-tert-butyl-5H-pyrazol-5-id-1-yl)-6-[2-[6-(3-tert-butyl-5H-pyrazol-5-id-1-yl)-2-pyridinyl]ethyl]pyridine;2-[diphenyl-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]methyl]-6-(3-methyl-5H-pyrazol-5-id-1-yl)pyridine;1-[6-[[6-(3-isocyano-5H-pyrazol-5-id-1-yl)-2-pyridinyl]oxy]-2-pyridinyl]-5H-pyrazol-5-ide-3-carbonitrile;2-(3-methyl-5H-pyrazol-5-id-1-yl)-6-[9-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]fluoren-9-yl]pyridine;2-(3-methyl-5H-pyrazol-5-id-1-yl)-6-[[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]sulfanyl]pyridine;pentakis(platinum(2+)) has a molecular weight of 3221.74 g/mol, XLogP of 23.70, 23 rotatable bonds, 0 hydrogen bond donors, and 33 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(3-tert-butyl-5H-pyrazol-5-id-1-yl)-6-[2-[6-(3-tert-butyl-5H-pyrazol-5-id-1-yl)-2-pyridinyl]ethyl]pyridine;2-[diphenyl-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]methyl]-6-(3-methyl-5H-pyrazol-5-id-1-yl)pyridine;1-[6-[[6-(3-isocyano-5H-pyrazol-5-id-1-yl)-2-pyridinyl]oxy]-2-pyridinyl]-5H-pyrazol-5-ide-3-carbonitrile;2-(3-methyl-5H-pyrazol-5-id-1-yl)-6-[9-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]fluoren-9-yl]pyridine;2-(3-methyl-5H-pyrazol-5-id-1-yl)-6-[[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]sulfanyl]pyridine;pentakis(platinum(2+)) is sourced from PubChem (CID 161283503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).