6-(3-tert-butyl-5H-pyrazol-5-id-1-yl)-2-[2-[6-(3-tert-butyl-5H-pyrazol-5-id-1-yl)-3-methyl-2-pyridinyl]propan-2-yl]-3-methylpyridine;2-[6-[2-[6-(5-cyano-4-isocyano-3H-pyrazol-3-id-2-yl)-4-methyl-2-pyridinyl]propan-2-yl]-4-methyl-2-pyridinyl]-5-isocyano-3H-pyrazol-3-ide-4-carbonitrile;2-(3-cyano-5H-pyrazol-5-id-1-yl)-6-[2-[4-isocyano-6-(3-isocyano-5H-pyrazol-5-id-1-yl)-2-pyridinyl]propan-2-yl]pyridine-4-carbonitrile;2-[6-[2-[6-(3H-indazol-3-id-2-yl)-4-methoxy-2-pyridinyl]propan-2-yl]-4-methoxy-2-pyridinyl]-3H-indazol-3-ide;tetrakis(palladium(2+))

C106H88N32O2Pd4 — CID 157380172

About 6-(3-tert-butyl-5H-pyrazol-5-id-1-yl)-2-[2-[6-(3-tert-butyl-5H-pyrazol-5-id-1-yl)-3-methyl-2-pyridinyl]propan-2-yl]-3-methylpyridine;2-[6-[2-[6-(5-cyano-4-isocyano-3H-pyrazol-3-id-2-yl)-4-methyl-2-pyridinyl]propan-2-yl]-4-methyl-2-pyridinyl]-5-isocyano-3H-pyrazol-3-ide-4-carbonitrile;2-(3-cyano-5H-pyrazol-5-id-1-yl)-6-[2-[4-isocyano-6-(3-isocyano-5H-pyrazol-5-id-1-yl)-2-pyridinyl]propan-2-yl]pyridine-4-carbonitrile;2-[6-[2-[6-(3H-indazol-3-id-2-yl)-4-methoxy-2-pyridinyl]propan-2-yl]-4-methoxy-2-pyridinyl]-3H-indazol-3-ide;tetrakis(palladium(2+))

6-(3-tert-butyl-5H-pyrazol-5-id-1-yl)-2-[2-[6-(3-tert-butyl-5H-pyrazol-5-id-1-yl)-3-methyl-2-pyridinyl]propan-2-yl]-3-methylpyridine;2-[6-[2-[6-(5-cyano-4-isocyano-3H-pyrazol-3-id-2-yl)-4-methyl-2-pyridinyl]propan-2-yl]-4-methyl-2-pyridinyl]-5-isocyano-3H-pyrazol-3-ide-4-carbonitrile;2-(3-cyano-5H-pyrazol-5-id-1-yl)-6-[2-[4-isocyano-6-(3-isocyano-5H-pyrazol-5-id-1-yl)-2-pyridinyl]propan-2-yl]pyridine-4-carbonitrile;2-[6-[2-[6-(3H-indazol-3-id-2-yl)-4-methoxy-2-pyridinyl]propan-2-yl]-4-methoxy-2-pyridinyl]-3H-indazol-3-ide;tetrakis(palladium(2+)) (PubChem CID 157380172) has the molecular formula C106H88N32O2Pd4 and a molecular weight of 2267.77 g/mol. Its IUPAC name is 6-(3-tert-butyl-5H-pyrazol-5-id-1-yl)-2-[2-[6-(3-tert-butyl-5H-pyrazol-5-id-1-yl)-3-methyl-2-pyridinyl]propan-2-yl]-3-methylpyridine;2-[6-[2-[6-(5-cyano-4-isocyano-3H-pyrazol-3-id-2-yl)-4-methyl-2-pyridinyl]propan-2-yl]-4-methyl-2-pyridinyl]-5-isocyano-3H-pyrazol-3-ide-4-carbonitrile;2-(3-cyano-5H-pyrazol-5-id-1-yl)-6-[2-[4-isocyano-6-(3-isocyano-5H-pyrazol-5-id-1-yl)-2-pyridinyl]propan-2-yl]pyridine-4-carbonitrile;2-[6-[2-[6-(3H-indazol-3-id-2-yl)-4-methoxy-2-pyridinyl]propan-2-yl]-4-methoxy-2-pyridinyl]-3H-indazol-3-ide;tetrakis(palladium(2+)).

Molecular Properties

• Compound Name: 6-(3-tert-butyl-5H-pyrazol-5-id-1-yl)-2-[2-[6-(3-tert-butyl-5H-pyrazol-5-id-1-yl)-3-methyl-2-pyridinyl]propan-2-yl]-3-methylpyridine;2-[6-[2-[6-(5-cyano-4-isocyano-3H-pyrazol-3-id-2-yl)-4-methyl-2-pyridinyl]propan-2-yl]-4-methyl-2-pyridinyl]-5-isocyano-3H-pyrazol-3-ide-4-carbonitrile;2-(3-cyano-5H-pyrazol-5-id-1-yl)-6-[2-[4-isocyano-6-(3-isocyano-5H-pyrazol-5-id-1-yl)-2-pyridinyl]propan-2-yl]pyridine-4-carbonitrile;2-[6-[2-[6-(3H-indazol-3-id-2-yl)-4-methoxy-2-pyridinyl]propan-2-yl]-4-methoxy-2-pyridinyl]-3H-indazol-3-ide;tetrakis(palladium(2+))
• PubChem CID: 157380172
• Molecular Formula: C106H88N32O2Pd4
• Molecular Weight: 2267.77 g/mol
• Exact Mass: 2264.39
• IUPAC Name: 6-(3-tert-butyl-5H-pyrazol-5-id-1-yl)-2-[2-[6-(3-tert-butyl-5H-pyrazol-5-id-1-yl)-3-methyl-2-pyridinyl]propan-2-yl]-3-methylpyridine;2-[6-[2-[6-(5-cyano-4-isocyano-3H-pyrazol-3-id-2-yl)-4-methyl-2-pyridinyl]propan-2-yl]-4-methyl-2-pyridinyl]-5-isocyano-3H-pyrazol-3-ide-4-carbonitrile;2-(3-cyano-5H-pyrazol-5-id-1-yl)-6-[2-[4-isocyano-6-(3-isocyano-5H-pyrazol-5-id-1-yl)-2-pyridinyl]propan-2-yl]pyridine-4-carbonitrile;2-[6-[2-[6-(3H-indazol-3-id-2-yl)-4-methoxy-2-pyridinyl]propan-2-yl]-4-methoxy-2-pyridinyl]-3H-indazol-3-ide;tetrakis(palladium(2+))
• SMILES: COc1cc(-n2[c-]c3ccccc3n2)nc(C(C)(C)c2cc(OC)cc(-n3[c-]c4ccccc4n3)n2)c1.Cc1ccc(-n2[c-]cc(C(C)(C)C)n2)nc1C(C)(C)c1nc(-n2[c-]cc(C(C)(C)C)n2)ccc1C.[C-]#[N+]c1[c-]n(-c2cc(C)cc(C(C)(C)c3cc(C)cc(-n4[c-]c(C#N)c([N+]#[C-])n4)n3)n2)nc1C#N.[C-]#[N+]c1cc(-n2[c-]cc([N+]#[C-])n2)nc(C(C)(C)c2cc(C#N)cc(-n3[c-]cc(C#N)n3)n2)c1.[Pd+2].[Pd+2].[Pd+2].[Pd+2]
• InChI: InChI=1S/C29H24N6O2.C29H36N6.C25H16N10.C23H12N10.4Pd/c1-29(2,25-13-21(36-3)15-27(30-25)34-17-19-9-5-7-11-23(19)32-34)26-14-22(37-4)16-28(31-26)35-18-20-10-6-8-12-24(20)33-35;1-19-11-13-23(34-17-15-21(32-34)27(3,4)5)30-25(19)29(9,10)26-20(2)12-14-24(31-26)35-18-16-22(33-35)28(6,7)8;1-15-7-20(30-22(9-15)34-13-17(11-26)24(29-6)33-34)25(3,4)21-8-16(2)10-23(31-21)35-14-19(28-5)18(12-27)32-35;1-23(2,18-9-15(13-24)10-21(28-18)32-7-5-16(14-25)30-32)19-11-17(26-3)12-22(29-19)33-8-6-20(27-4)31-33;;;;/h5-16H,1-4H3;11-16H,1-10H3;7-10H,1-4H3;5-6,9-12H,1-2H3;;;;/q4*-2;4*+2
• InChIKey: QAQWUXNGSUTFOU-UHFFFAOYSA-N
• XLogP: 18.93
• TPSA: 376.74 Ų
• H-Bond Acceptors: 30
• Rotatable Bonds: 18
• Heavy Atoms: 144
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2267.77
LogP ≤ 5	18.93
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	30

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 6-(3-tert-butyl-5H-pyrazol-5-id-1-yl)-2-[2-[6-(3-tert-butyl-5H-pyrazol-5-id-1-yl)-3-methyl-2-pyridinyl]propan-2-yl]-3-methylpyridine;2-[6-[2-[6-(5-cyano-4-isocyano-3H-pyrazol-3-id-2-yl)-4-methyl-2-pyridinyl]propan-2-yl]-4-methyl-2-pyridinyl]-5-isocyano-3H-pyrazol-3-ide-4-carbonitrile;2-(3-cyano-5H-pyrazol-5-id-1-yl)-6-[2-[4-isocyano-6-(3-isocyano-5H-pyrazol-5-id-1-yl)-2-pyridinyl]propan-2-yl]pyridine-4-carbonitrile;2-[6-[2-[6-(3H-indazol-3-id-2-yl)-4-methoxy-2-pyridinyl]propan-2-yl]-4-methoxy-2-pyridinyl]-3H-indazol-3-ide;tetrakis(palladium(2+))?

The IUPAC name of 6-(3-tert-butyl-5H-pyrazol-5-id-1-yl)-2-[2-[6-(3-tert-butyl-5H-pyrazol-5-id-1-yl)-3-methyl-2-pyridinyl]propan-2-yl]-3-methylpyridine;2-[6-[2-[6-(5-cyano-4-isocyano-3H-pyrazol-3-id-2-yl)-4-methyl-2-pyridinyl]propan-2-yl]-4-methyl-2-pyridinyl]-5-isocyano-3H-pyrazol-3-ide-4-carbonitrile;2-(3-cyano-5H-pyrazol-5-id-1-yl)-6-[2-[4-isocyano-6-(3-isocyano-5H-pyrazol-5-id-1-yl)-2-pyridinyl]propan-2-yl]pyridine-4-carbonitrile;2-[6-[2-[6-(3H-indazol-3-id-2-yl)-4-methoxy-2-pyridinyl]propan-2-yl]-4-methoxy-2-pyridinyl]-3H-indazol-3-ide;tetrakis(palladium(2+)) (CID 157380172) is 6-(3-tert-butyl-5H-pyrazol-5-id-1-yl)-2-[2-[6-(3-tert-butyl-5H-pyrazol-5-id-1-yl)-3-methyl-2-pyridinyl]propan-2-yl]-3-methylpyridine;2-[6-[2-[6-(5-cyano-4-isocyano-3H-pyrazol-3-id-2-yl)-4-methyl-2-pyridinyl]propan-2-yl]-4-methyl-2-pyridinyl]-5-isocyano-3H-pyrazol-3-ide-4-carbonitrile;2-(3-cyano-5H-pyrazol-5-id-1-yl)-6-[2-[4-isocyano-6-(3-isocyano-5H-pyrazol-5-id-1-yl)-2-pyridinyl]propan-2-yl]pyridine-4-carbonitrile;2-[6-[2-[6-(3H-indazol-3-id-2-yl)-4-methoxy-2-pyridinyl]propan-2-yl]-4-methoxy-2-pyridinyl]-3H-indazol-3-ide;tetrakis(palladium(2+)).

What is the SMILES notation for 6-(3-tert-butyl-5H-pyrazol-5-id-1-yl)-2-[2-[6-(3-tert-butyl-5H-pyrazol-5-id-1-yl)-3-methyl-2-pyridinyl]propan-2-yl]-3-methylpyridine;2-[6-[2-[6-(5-cyano-4-isocyano-3H-pyrazol-3-id-2-yl)-4-methyl-2-pyridinyl]propan-2-yl]-4-methyl-2-pyridinyl]-5-isocyano-3H-pyrazol-3-ide-4-carbonitrile;2-(3-cyano-5H-pyrazol-5-id-1-yl)-6-[2-[4-isocyano-6-(3-isocyano-5H-pyrazol-5-id-1-yl)-2-pyridinyl]propan-2-yl]pyridine-4-carbonitrile;2-[6-[2-[6-(3H-indazol-3-id-2-yl)-4-methoxy-2-pyridinyl]propan-2-yl]-4-methoxy-2-pyridinyl]-3H-indazol-3-ide;tetrakis(palladium(2+))?

The canonical SMILES for 6-(3-tert-butyl-5H-pyrazol-5-id-1-yl)-2-[2-[6-(3-tert-butyl-5H-pyrazol-5-id-1-yl)-3-methyl-2-pyridinyl]propan-2-yl]-3-methylpyridine;2-[6-[2-[6-(5-cyano-4-isocyano-3H-pyrazol-3-id-2-yl)-4-methyl-2-pyridinyl]propan-2-yl]-4-methyl-2-pyridinyl]-5-isocyano-3H-pyrazol-3-ide-4-carbonitrile;2-(3-cyano-5H-pyrazol-5-id-1-yl)-6-[2-[4-isocyano-6-(3-isocyano-5H-pyrazol-5-id-1-yl)-2-pyridinyl]propan-2-yl]pyridine-4-carbonitrile;2-[6-[2-[6-(3H-indazol-3-id-2-yl)-4-methoxy-2-pyridinyl]propan-2-yl]-4-methoxy-2-pyridinyl]-3H-indazol-3-ide;tetrakis(palladium(2+)) is COc1cc(-n2[c-]c3ccccc3n2)nc(C(C)(C)c2cc(OC)cc(-n3[c-]c4ccccc4n3)n2)c1.Cc1ccc(-n2[c-]cc(C(C)(C)C)n2)nc1C(C)(C)c1nc(-n2[c-]cc(C(C)(C)C)n2)ccc1C.[C-]#[N+]c1[c-]n(-c2cc(C)cc(C(C)(C)c3cc(C)cc(-n4[c-]c(C#N)c([N+]#[C-])n4)n3)n2)nc1C#N.[C-]#[N+]c1cc(-n2[c-]cc([N+]#[C-])n2)nc(C(C)(C)c2cc(C#N)cc(-n3[c-]cc(C#N)n3)n2)c1.[Pd+2].[Pd+2].[Pd+2].[Pd+2].

What is the InChIKey of 6-(3-tert-butyl-5H-pyrazol-5-id-1-yl)-2-[2-[6-(3-tert-butyl-5H-pyrazol-5-id-1-yl)-3-methyl-2-pyridinyl]propan-2-yl]-3-methylpyridine;2-[6-[2-[6-(5-cyano-4-isocyano-3H-pyrazol-3-id-2-yl)-4-methyl-2-pyridinyl]propan-2-yl]-4-methyl-2-pyridinyl]-5-isocyano-3H-pyrazol-3-ide-4-carbonitrile;2-(3-cyano-5H-pyrazol-5-id-1-yl)-6-[2-[4-isocyano-6-(3-isocyano-5H-pyrazol-5-id-1-yl)-2-pyridinyl]propan-2-yl]pyridine-4-carbonitrile;2-[6-[2-[6-(3H-indazol-3-id-2-yl)-4-methoxy-2-pyridinyl]propan-2-yl]-4-methoxy-2-pyridinyl]-3H-indazol-3-ide;tetrakis(palladium(2+))?

The InChIKey is QAQWUXNGSUTFOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H24N6O2.C29H36N6.C25H16N10.C23H12N10.4Pd/c1-29(2,25-13-21(36-3)15-27(30-25)34-17-19-9-5-7-11-23(19)32-34)26-14-22(37-4)16-28(31-26)35-18-20-10-6-8-12-24(20)33-35;1-19-11-13-23(34-17-15-21(32-34)27(3,4)5)30-25(19)29(9,10)26-20(2)12-14-24(31-26)35-18-16-22(33-35)28(6,7)8;1-15-7-20(30-22(9-15)34-13-17(11-26)24(29-6)33-34)25(3,4)21-8-16(2)10-23(31-21)35-14-19(28-5)18(12-27)32-35;1-23(2,18-9-15(13-24)10-21(28-18)32-7-5-16(14-25)30-32)19-11-17(26-3)12-22(29-19)33-8-6-20(27-4)31-33;;;;/h5-16H,1-4H3;11-16H,1-10H3;7-10H,1-4H3;5-6,9-12H,1-2H3;;;;/q4*-2;4*+2.

What are the key properties of 6-(3-tert-butyl-5H-pyrazol-5-id-1-yl)-2-[2-[6-(3-tert-butyl-5H-pyrazol-5-id-1-yl)-3-methyl-2-pyridinyl]propan-2-yl]-3-methylpyridine;2-[6-[2-[6-(5-cyano-4-isocyano-3H-pyrazol-3-id-2-yl)-4-methyl-2-pyridinyl]propan-2-yl]-4-methyl-2-pyridinyl]-5-isocyano-3H-pyrazol-3-ide-4-carbonitrile;2-(3-cyano-5H-pyrazol-5-id-1-yl)-6-[2-[4-isocyano-6-(3-isocyano-5H-pyrazol-5-id-1-yl)-2-pyridinyl]propan-2-yl]pyridine-4-carbonitrile;2-[6-[2-[6-(3H-indazol-3-id-2-yl)-4-methoxy-2-pyridinyl]propan-2-yl]-4-methoxy-2-pyridinyl]-3H-indazol-3-ide;tetrakis(palladium(2+))?

6-(3-tert-butyl-5H-pyrazol-5-id-1-yl)-2-[2-[6-(3-tert-butyl-5H-pyrazol-5-id-1-yl)-3-methyl-2-pyridinyl]propan-2-yl]-3-methylpyridine;2-[6-[2-[6-(5-cyano-4-isocyano-3H-pyrazol-3-id-2-yl)-4-methyl-2-pyridinyl]propan-2-yl]-4-methyl-2-pyridinyl]-5-isocyano-3H-pyrazol-3-ide-4-carbonitrile;2-(3-cyano-5H-pyrazol-5-id-1-yl)-6-[2-[4-isocyano-6-(3-isocyano-5H-pyrazol-5-id-1-yl)-2-pyridinyl]propan-2-yl]pyridine-4-carbonitrile;2-[6-[2-[6-(3H-indazol-3-id-2-yl)-4-methoxy-2-pyridinyl]propan-2-yl]-4-methoxy-2-pyridinyl]-3H-indazol-3-ide;tetrakis(palladium(2+)) has a molecular weight of 2267.77 g/mol, XLogP of 18.93, 18 rotatable bonds, 0 hydrogen bond donors, and 30 hydrogen bond acceptors.

Where does this data come from?

All data for 6-(3-tert-butyl-5H-pyrazol-5-id-1-yl)-2-[2-[6-(3-tert-butyl-5H-pyrazol-5-id-1-yl)-3-methyl-2-pyridinyl]propan-2-yl]-3-methylpyridine;2-[6-[2-[6-(5-cyano-4-isocyano-3H-pyrazol-3-id-2-yl)-4-methyl-2-pyridinyl]propan-2-yl]-4-methyl-2-pyridinyl]-5-isocyano-3H-pyrazol-3-ide-4-carbonitrile;2-(3-cyano-5H-pyrazol-5-id-1-yl)-6-[2-[4-isocyano-6-(3-isocyano-5H-pyrazol-5-id-1-yl)-2-pyridinyl]propan-2-yl]pyridine-4-carbonitrile;2-[6-[2-[6-(3H-indazol-3-id-2-yl)-4-methoxy-2-pyridinyl]propan-2-yl]-4-methoxy-2-pyridinyl]-3H-indazol-3-ide;tetrakis(palladium(2+)) is sourced from PubChem (CID 157380172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).