1-[4-(dimethylamino)-6-[2-[6-(3-isocyano-5H-pyrazol-5-id-1-yl)-4-methoxy-2-pyridinyl]propan-2-yl]-2-pyridinyl]-5H-pyrazol-5-ide-3-carbonitrile;2-[2-[4-(dimethylamino)-6-[3-(2,3,4,5,6-pentafluorophenyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-N,N-dimethyl-6-[3-(2,3,4,5,6-pentafluorophenyl)-5H-pyrazol-5-id-1-yl]pyridin-4-amine;2-[2-[4-(dimethylamino)-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-N,N-dimethyl-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridin-4-amine;6-[2-[4,5-dimethyl-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-3,4-dimethyl-2-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridine;tetrakis(palladium(2+))

C109H91F22N31OPd4 — CID 161160828

About 1-[4-(dimethylamino)-6-[2-[6-(3-isocyano-5H-pyrazol-5-id-1-yl)-4-methoxy-2-pyridinyl]propan-2-yl]-2-pyridinyl]-5H-pyrazol-5-ide-3-carbonitrile;2-[2-[4-(dimethylamino)-6-[3-(2,3,4,5,6-pentafluorophenyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-N,N-dimethyl-6-[3-(2,3,4,5,6-pentafluorophenyl)-5H-pyrazol-5-id-1-yl]pyridin-4-amine;2-[2-[4-(dimethylamino)-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-N,N-dimethyl-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridin-4-amine;6-[2-[4,5-dimethyl-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-3,4-dimethyl-2-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridine;tetrakis(palladium(2+))

1-[4-(dimethylamino)-6-[2-[6-(3-isocyano-5H-pyrazol-5-id-1-yl)-4-methoxy-2-pyridinyl]propan-2-yl]-2-pyridinyl]-5H-pyrazol-5-ide-3-carbonitrile;2-[2-[4-(dimethylamino)-6-[3-(2,3,4,5,6-pentafluorophenyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-N,N-dimethyl-6-[3-(2,3,4,5,6-pentafluorophenyl)-5H-pyrazol-5-id-1-yl]pyridin-4-amine;2-[2-[4-(dimethylamino)-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-N,N-dimethyl-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridin-4-amine;6-[2-[4,5-dimethyl-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-3,4-dimethyl-2-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridine;tetrakis(palladium(2+)) (PubChem CID 161160828) has the molecular formula C109H91F22N31OPd4 and a molecular weight of 2694.78 g/mol. Its IUPAC name is 1-[4-(dimethylamino)-6-[2-[6-(3-isocyano-5H-pyrazol-5-id-1-yl)-4-methoxy-2-pyridinyl]propan-2-yl]-2-pyridinyl]-5H-pyrazol-5-ide-3-carbonitrile;2-[2-[4-(dimethylamino)-6-[3-(2,3,4,5,6-pentafluorophenyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-N,N-dimethyl-6-[3-(2,3,4,5,6-pentafluorophenyl)-5H-pyrazol-5-id-1-yl]pyridin-4-amine;2-[2-[4-(dimethylamino)-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-N,N-dimethyl-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridin-4-amine;6-[2-[4,5-dimethyl-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-3,4-dimethyl-2-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridine;tetrakis(palladium(2+)).

Molecular Properties

• Compound Name: 1-[4-(dimethylamino)-6-[2-[6-(3-isocyano-5H-pyrazol-5-id-1-yl)-4-methoxy-2-pyridinyl]propan-2-yl]-2-pyridinyl]-5H-pyrazol-5-ide-3-carbonitrile;2-[2-[4-(dimethylamino)-6-[3-(2,3,4,5,6-pentafluorophenyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-N,N-dimethyl-6-[3-(2,3,4,5,6-pentafluorophenyl)-5H-pyrazol-5-id-1-yl]pyridin-4-amine;2-[2-[4-(dimethylamino)-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-N,N-dimethyl-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridin-4-amine;6-[2-[4,5-dimethyl-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-3,4-dimethyl-2-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridine;tetrakis(palladium(2+))
• PubChem CID: 161160828
• Molecular Formula: C109H91F22N31OPd4
• Molecular Weight: 2694.78 g/mol
• Exact Mass: 2691.38
• IUPAC Name: 1-[4-(dimethylamino)-6-[2-[6-(3-isocyano-5H-pyrazol-5-id-1-yl)-4-methoxy-2-pyridinyl]propan-2-yl]-2-pyridinyl]-5H-pyrazol-5-ide-3-carbonitrile;2-[2-[4-(dimethylamino)-6-[3-(2,3,4,5,6-pentafluorophenyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-N,N-dimethyl-6-[3-(2,3,4,5,6-pentafluorophenyl)-5H-pyrazol-5-id-1-yl]pyridin-4-amine;2-[2-[4-(dimethylamino)-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-N,N-dimethyl-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridin-4-amine;6-[2-[4,5-dimethyl-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-3,4-dimethyl-2-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridine;tetrakis(palladium(2+))
• SMILES: CN(C)c1cc(-n2[c-]cc(-c3c(F)c(F)c(F)c(F)c3F)n2)nc(C(C)(C)c2cc(N(C)C)cc(-n3[c-]cc(-c4c(F)c(F)c(F)c(F)c4F)n3)n2)c1.CN(C)c1cc(-n2[c-]cc(C(F)(F)F)n2)nc(C(C)(C)c2cc(N(C)C)cc(-n3[c-]cc(C(F)(F)F)n3)n2)c1.Cc1cc(C(C)(C)c2cc(C)c(C)c(-n3[c-]cc(C(F)(F)F)n3)n2)nc(-n2[c-]cc(C(F)(F)F)n2)c1C.[C-]#[N+]c1c[c-]n(-c2cc(OC)cc(C(C)(C)c3cc(N(C)C)cc(-n4[c-]cc(C#N)n4)n3)n2)n1.[Pd+2].[Pd+2].[Pd+2].[Pd+2]
• InChI: InChI=1S/C35H24F10N8.C25H24F6N8.C25H22F6N6.C24H21N9O.4Pd/c1-35(2,19-11-15(50(3)4)13-21(46-19)52-9-7-17(48-52)23-25(36)29(40)33(44)30(41)26(23)37)20-12-16(51(5)6)14-22(47-20)53-10-8-18(49-53)24-27(38)31(42)34(45)32(43)28(24)39;1-23(2,19-11-15(36(3)4)13-21(32-19)38-9-7-17(34-38)24(26,27)28)20-12-16(37(5)6)14-22(33-20)39-10-8-18(35-39)25(29,30)31;1-13-11-19(32-21(15(13)3)36-9-7-17(34-36)24(26,27)28)23(5,6)20-12-14(2)16(4)22(33-20)37-10-8-18(35-37)25(29,30)31;1-24(2,20-13-18(34-6)14-23(28-20)33-10-8-21(26-3)30-33)19-11-17(31(4)5)12-22(27-19)32-9-7-16(15-25)29-32;;;;/h7-8,11-14H,1-6H3;7-8,11-14H,1-6H3;7-8,11-12H,1-6H3;7-8,11-14H,1-2,4-6H3;;;;/q4*-2;4*+2
• InChIKey: SDZXQWJTDLWJGG-UHFFFAOYSA-N
• XLogP: 21.88
• TPSA: 299.26 Ų
• H-Bond Acceptors: 31
• Rotatable Bonds: 24
• Heavy Atoms: 167
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2694.78
LogP ≤ 5	21.88
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	31

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}, {'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 1-[4-(dimethylamino)-6-[2-[6-(3-isocyano-5H-pyrazol-5-id-1-yl)-4-methoxy-2-pyridinyl]propan-2-yl]-2-pyridinyl]-5H-pyrazol-5-ide-3-carbonitrile;2-[2-[4-(dimethylamino)-6-[3-(2,3,4,5,6-pentafluorophenyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-N,N-dimethyl-6-[3-(2,3,4,5,6-pentafluorophenyl)-5H-pyrazol-5-id-1-yl]pyridin-4-amine;2-[2-[4-(dimethylamino)-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-N,N-dimethyl-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridin-4-amine;6-[2-[4,5-dimethyl-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-3,4-dimethyl-2-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridine;tetrakis(palladium(2+))?

The IUPAC name of 1-[4-(dimethylamino)-6-[2-[6-(3-isocyano-5H-pyrazol-5-id-1-yl)-4-methoxy-2-pyridinyl]propan-2-yl]-2-pyridinyl]-5H-pyrazol-5-ide-3-carbonitrile;2-[2-[4-(dimethylamino)-6-[3-(2,3,4,5,6-pentafluorophenyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-N,N-dimethyl-6-[3-(2,3,4,5,6-pentafluorophenyl)-5H-pyrazol-5-id-1-yl]pyridin-4-amine;2-[2-[4-(dimethylamino)-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-N,N-dimethyl-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridin-4-amine;6-[2-[4,5-dimethyl-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-3,4-dimethyl-2-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridine;tetrakis(palladium(2+)) (CID 161160828) is 1-[4-(dimethylamino)-6-[2-[6-(3-isocyano-5H-pyrazol-5-id-1-yl)-4-methoxy-2-pyridinyl]propan-2-yl]-2-pyridinyl]-5H-pyrazol-5-ide-3-carbonitrile;2-[2-[4-(dimethylamino)-6-[3-(2,3,4,5,6-pentafluorophenyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-N,N-dimethyl-6-[3-(2,3,4,5,6-pentafluorophenyl)-5H-pyrazol-5-id-1-yl]pyridin-4-amine;2-[2-[4-(dimethylamino)-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-N,N-dimethyl-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridin-4-amine;6-[2-[4,5-dimethyl-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-3,4-dimethyl-2-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridine;tetrakis(palladium(2+)).

What is the SMILES notation for 1-[4-(dimethylamino)-6-[2-[6-(3-isocyano-5H-pyrazol-5-id-1-yl)-4-methoxy-2-pyridinyl]propan-2-yl]-2-pyridinyl]-5H-pyrazol-5-ide-3-carbonitrile;2-[2-[4-(dimethylamino)-6-[3-(2,3,4,5,6-pentafluorophenyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-N,N-dimethyl-6-[3-(2,3,4,5,6-pentafluorophenyl)-5H-pyrazol-5-id-1-yl]pyridin-4-amine;2-[2-[4-(dimethylamino)-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-N,N-dimethyl-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridin-4-amine;6-[2-[4,5-dimethyl-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-3,4-dimethyl-2-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridine;tetrakis(palladium(2+))?

The canonical SMILES for 1-[4-(dimethylamino)-6-[2-[6-(3-isocyano-5H-pyrazol-5-id-1-yl)-4-methoxy-2-pyridinyl]propan-2-yl]-2-pyridinyl]-5H-pyrazol-5-ide-3-carbonitrile;2-[2-[4-(dimethylamino)-6-[3-(2,3,4,5,6-pentafluorophenyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-N,N-dimethyl-6-[3-(2,3,4,5,6-pentafluorophenyl)-5H-pyrazol-5-id-1-yl]pyridin-4-amine;2-[2-[4-(dimethylamino)-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-N,N-dimethyl-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridin-4-amine;6-[2-[4,5-dimethyl-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-3,4-dimethyl-2-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridine;tetrakis(palladium(2+)) is CN(C)c1cc(-n2[c-]cc(-c3c(F)c(F)c(F)c(F)c3F)n2)nc(C(C)(C)c2cc(N(C)C)cc(-n3[c-]cc(-c4c(F)c(F)c(F)c(F)c4F)n3)n2)c1.CN(C)c1cc(-n2[c-]cc(C(F)(F)F)n2)nc(C(C)(C)c2cc(N(C)C)cc(-n3[c-]cc(C(F)(F)F)n3)n2)c1.Cc1cc(C(C)(C)c2cc(C)c(C)c(-n3[c-]cc(C(F)(F)F)n3)n2)nc(-n2[c-]cc(C(F)(F)F)n2)c1C.[C-]#[N+]c1c[c-]n(-c2cc(OC)cc(C(C)(C)c3cc(N(C)C)cc(-n4[c-]cc(C#N)n4)n3)n2)n1.[Pd+2].[Pd+2].[Pd+2].[Pd+2].

What is the InChIKey of 1-[4-(dimethylamino)-6-[2-[6-(3-isocyano-5H-pyrazol-5-id-1-yl)-4-methoxy-2-pyridinyl]propan-2-yl]-2-pyridinyl]-5H-pyrazol-5-ide-3-carbonitrile;2-[2-[4-(dimethylamino)-6-[3-(2,3,4,5,6-pentafluorophenyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-N,N-dimethyl-6-[3-(2,3,4,5,6-pentafluorophenyl)-5H-pyrazol-5-id-1-yl]pyridin-4-amine;2-[2-[4-(dimethylamino)-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-N,N-dimethyl-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridin-4-amine;6-[2-[4,5-dimethyl-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-3,4-dimethyl-2-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridine;tetrakis(palladium(2+))?

The InChIKey is SDZXQWJTDLWJGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C35H24F10N8.C25H24F6N8.C25H22F6N6.C24H21N9O.4Pd/c1-35(2,19-11-15(50(3)4)13-21(46-19)52-9-7-17(48-52)23-25(36)29(40)33(44)30(41)26(23)37)20-12-16(51(5)6)14-22(47-20)53-10-8-18(49-53)24-27(38)31(42)34(45)32(43)28(24)39;1-23(2,19-11-15(36(3)4)13-21(32-19)38-9-7-17(34-38)24(26,27)28)20-12-16(37(5)6)14-22(33-20)39-10-8-18(35-39)25(29,30)31;1-13-11-19(32-21(15(13)3)36-9-7-17(34-36)24(26,27)28)23(5,6)20-12-14(2)16(4)22(33-20)37-10-8-18(35-37)25(29,30)31;1-24(2,20-13-18(34-6)14-23(28-20)33-10-8-21(26-3)30-33)19-11-17(31(4)5)12-22(27-19)32-9-7-16(15-25)29-32;;;;/h7-8,11-14H,1-6H3;7-8,11-14H,1-6H3;7-8,11-12H,1-6H3;7-8,11-14H,1-2,4-6H3;;;;/q4*-2;4*+2.

What are the key properties of 1-[4-(dimethylamino)-6-[2-[6-(3-isocyano-5H-pyrazol-5-id-1-yl)-4-methoxy-2-pyridinyl]propan-2-yl]-2-pyridinyl]-5H-pyrazol-5-ide-3-carbonitrile;2-[2-[4-(dimethylamino)-6-[3-(2,3,4,5,6-pentafluorophenyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-N,N-dimethyl-6-[3-(2,3,4,5,6-pentafluorophenyl)-5H-pyrazol-5-id-1-yl]pyridin-4-amine;2-[2-[4-(dimethylamino)-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-N,N-dimethyl-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridin-4-amine;6-[2-[4,5-dimethyl-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-3,4-dimethyl-2-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridine;tetrakis(palladium(2+))?

1-[4-(dimethylamino)-6-[2-[6-(3-isocyano-5H-pyrazol-5-id-1-yl)-4-methoxy-2-pyridinyl]propan-2-yl]-2-pyridinyl]-5H-pyrazol-5-ide-3-carbonitrile;2-[2-[4-(dimethylamino)-6-[3-(2,3,4,5,6-pentafluorophenyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-N,N-dimethyl-6-[3-(2,3,4,5,6-pentafluorophenyl)-5H-pyrazol-5-id-1-yl]pyridin-4-amine;2-[2-[4-(dimethylamino)-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-N,N-dimethyl-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridin-4-amine;6-[2-[4,5-dimethyl-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-3,4-dimethyl-2-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridine;tetrakis(palladium(2+)) has a molecular weight of 2694.78 g/mol, XLogP of 21.88, 24 rotatable bonds, 0 hydrogen bond donors, and 31 hydrogen bond acceptors.

Where does this data come from?

All data for 1-[4-(dimethylamino)-6-[2-[6-(3-isocyano-5H-pyrazol-5-id-1-yl)-4-methoxy-2-pyridinyl]propan-2-yl]-2-pyridinyl]-5H-pyrazol-5-ide-3-carbonitrile;2-[2-[4-(dimethylamino)-6-[3-(2,3,4,5,6-pentafluorophenyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-N,N-dimethyl-6-[3-(2,3,4,5,6-pentafluorophenyl)-5H-pyrazol-5-id-1-yl]pyridin-4-amine;2-[2-[4-(dimethylamino)-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-N,N-dimethyl-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridin-4-amine;6-[2-[4,5-dimethyl-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-3,4-dimethyl-2-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridine;tetrakis(palladium(2+)) is sourced from PubChem (CID 161160828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).