9-[3-(3,6-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]-2-pyridin-2-yl-1H-carbazol-1-ide;9-[3-[diphenyl(pyridin-2-yl)methyl]benzene-2-id-1-yl]-2-pyridin-2-yl-1H-carbazol-1-ide;pentakis(palladium(2+));2-pyridin-2-yl-9-[3-(9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(2-pyridin-2-ylpropan-2-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(2,2,4,4-tetramethyl-3-pyridin-2-ylpentan-3-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide

C199H151N15Pd5 — CID 159217179

About 9-[3-(3,6-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]-2-pyridin-2-yl-1H-carbazol-1-ide;9-[3-[diphenyl(pyridin-2-yl)methyl]benzene-2-id-1-yl]-2-pyridin-2-yl-1H-carbazol-1-ide;pentakis(palladium(2+));2-pyridin-2-yl-9-[3-(9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(2-pyridin-2-ylpropan-2-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(2,2,4,4-tetramethyl-3-pyridin-2-ylpentan-3-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide

9-[3-(3,6-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]-2-pyridin-2-yl-1H-carbazol-1-ide;9-[3-[diphenyl(pyridin-2-yl)methyl]benzene-2-id-1-yl]-2-pyridin-2-yl-1H-carbazol-1-ide;pentakis(palladium(2+));2-pyridin-2-yl-9-[3-(9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(2-pyridin-2-ylpropan-2-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(2,2,4,4-tetramethyl-3-pyridin-2-ylpentan-3-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide (PubChem CID 159217179) has the molecular formula C199H151N15Pd5 and a molecular weight of 3284.60 g/mol. Its IUPAC name is 9-[3-(3,6-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]-2-pyridin-2-yl-1H-carbazol-1-ide;9-[3-[diphenyl(pyridin-2-yl)methyl]benzene-2-id-1-yl]-2-pyridin-2-yl-1H-carbazol-1-ide;pentakis(palladium(2+));2-pyridin-2-yl-9-[3-(9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(2-pyridin-2-ylpropan-2-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(2,2,4,4-tetramethyl-3-pyridin-2-ylpentan-3-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide.

Molecular Properties

• Compound Name: 9-[3-(3,6-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]-2-pyridin-2-yl-1H-carbazol-1-ide;9-[3-[diphenyl(pyridin-2-yl)methyl]benzene-2-id-1-yl]-2-pyridin-2-yl-1H-carbazol-1-ide;pentakis(palladium(2+));2-pyridin-2-yl-9-[3-(9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(2-pyridin-2-ylpropan-2-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(2,2,4,4-tetramethyl-3-pyridin-2-ylpentan-3-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide
• PubChem CID: 159217179
• Molecular Formula: C199H151N15Pd5
• Molecular Weight: 3284.60 g/mol
• Exact Mass: 3279.75
• IUPAC Name: 9-[3-(3,6-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]-2-pyridin-2-yl-1H-carbazol-1-ide;9-[3-[diphenyl(pyridin-2-yl)methyl]benzene-2-id-1-yl]-2-pyridin-2-yl-1H-carbazol-1-ide;pentakis(palladium(2+));2-pyridin-2-yl-9-[3-(9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(2-pyridin-2-ylpropan-2-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(2,2,4,4-tetramethyl-3-pyridin-2-ylpentan-3-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide
• SMILES: CC(C)(C)C(c1[c-]c(-n2c3[c-]c(-c4ccccn4)ccc3c3ccccc32)ccc1)(c1ccccn1)C(C)(C)C.CC(C)(C)c1ccc2c(c1)-c1cc(C(C)(C)C)ccc1C2(c1[c-]c(-n2c3[c-]c(-c4ccccn4)ccc3c3ccccc32)ccc1)c1ccccn1.CC(C)(c1[c-]c(-n2c3[c-]c(-c4ccccn4)ccc3c3ccccc32)ccc1)c1ccccn1.[Pd+2].[Pd+2].[Pd+2].[Pd+2].[Pd+2].[c-]1c(-n2c3[c-]c(-c4ccccn4)ccc3c3ccccc32)cccc1C(c1ccccc1)(c1ccccc1)c1ccccn1.[c-]1c(-n2c3[c-]c(-c4ccccn4)ccc3c3ccccc32)cccc1C1(c2ccccn2)c2ccccc2-c2ccccc21
• InChI: InChI=1S/C49H41N3.C41H25N3.C41H27N3.C37H35N3.C31H23N3.5Pd/c1-47(2,3)33-21-24-41-39(30-33)40-31-34(48(4,5)6)22-25-42(40)49(41,46-19-10-12-27-51-46)35-14-13-15-36(29-35)52-44-18-8-7-16-37(44)38-23-20-32(28-45(38)52)43-17-9-11-26-50-43;1-4-17-35-31(14-1)32-15-2-5-18-36(32)41(35,40-21-8-10-25-43-40)29-12-11-13-30(27-29)44-38-20-6-3-16-33(38)34-23-22-28(26-39(34)44)37-19-7-9-24-42-37;1-3-14-31(15-4-1)41(32-16-5-2-6-17-32,40-23-10-12-27-43-40)33-18-13-19-34(29-33)44-38-22-8-7-20-35(38)36-25-24-30(28-39(36)44)37-21-9-11-26-42-37;1-35(2,3)37(36(4,5)6,34-19-10-12-23-39-34)27-14-13-15-28(25-27)40-32-18-8-7-16-29(32)30-21-20-26(24-33(30)40)31-17-9-11-22-38-31;1-31(2,30-15-6-8-19-33-30)23-10-9-11-24(21-23)34-28-14-4-3-12-25(28)26-17-16-22(20-29(26)34)27-13-5-7-18-32-27;;;;;/h7-27,30-31H,1-6H3;1-25H;1-27H;7-23H,1-6H3;3-19H,1-2H3;;;;;/q5*-2;5*+2
• InChIKey: NASOETVPYLKXIQ-UHFFFAOYSA-N
• XLogP: 46.60
• TPSA: 153.55 Ų
• H-Bond Acceptors: 15
• Rotatable Bonds: 22
• Heavy Atoms: 219
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3284.60
LogP ≤ 5	46.60
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	15

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 9-[3-(3,6-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]-2-pyridin-2-yl-1H-carbazol-1-ide;9-[3-[diphenyl(pyridin-2-yl)methyl]benzene-2-id-1-yl]-2-pyridin-2-yl-1H-carbazol-1-ide;pentakis(palladium(2+));2-pyridin-2-yl-9-[3-(9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(2-pyridin-2-ylpropan-2-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(2,2,4,4-tetramethyl-3-pyridin-2-ylpentan-3-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide?

The IUPAC name of 9-[3-(3,6-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]-2-pyridin-2-yl-1H-carbazol-1-ide;9-[3-[diphenyl(pyridin-2-yl)methyl]benzene-2-id-1-yl]-2-pyridin-2-yl-1H-carbazol-1-ide;pentakis(palladium(2+));2-pyridin-2-yl-9-[3-(9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(2-pyridin-2-ylpropan-2-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(2,2,4,4-tetramethyl-3-pyridin-2-ylpentan-3-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide (CID 159217179) is 9-[3-(3,6-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]-2-pyridin-2-yl-1H-carbazol-1-ide;9-[3-[diphenyl(pyridin-2-yl)methyl]benzene-2-id-1-yl]-2-pyridin-2-yl-1H-carbazol-1-ide;pentakis(palladium(2+));2-pyridin-2-yl-9-[3-(9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(2-pyridin-2-ylpropan-2-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(2,2,4,4-tetramethyl-3-pyridin-2-ylpentan-3-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide.

What is the SMILES notation for 9-[3-(3,6-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]-2-pyridin-2-yl-1H-carbazol-1-ide;9-[3-[diphenyl(pyridin-2-yl)methyl]benzene-2-id-1-yl]-2-pyridin-2-yl-1H-carbazol-1-ide;pentakis(palladium(2+));2-pyridin-2-yl-9-[3-(9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(2-pyridin-2-ylpropan-2-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(2,2,4,4-tetramethyl-3-pyridin-2-ylpentan-3-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide?

The canonical SMILES for 9-[3-(3,6-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]-2-pyridin-2-yl-1H-carbazol-1-ide;9-[3-[diphenyl(pyridin-2-yl)methyl]benzene-2-id-1-yl]-2-pyridin-2-yl-1H-carbazol-1-ide;pentakis(palladium(2+));2-pyridin-2-yl-9-[3-(9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(2-pyridin-2-ylpropan-2-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(2,2,4,4-tetramethyl-3-pyridin-2-ylpentan-3-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide is CC(C)(C)C(c1[c-]c(-n2c3[c-]c(-c4ccccn4)ccc3c3ccccc32)ccc1)(c1ccccn1)C(C)(C)C.CC(C)(C)c1ccc2c(c1)-c1cc(C(C)(C)C)ccc1C2(c1[c-]c(-n2c3[c-]c(-c4ccccn4)ccc3c3ccccc32)ccc1)c1ccccn1.CC(C)(c1[c-]c(-n2c3[c-]c(-c4ccccn4)ccc3c3ccccc32)ccc1)c1ccccn1.[Pd+2].[Pd+2].[Pd+2].[Pd+2].[Pd+2].[c-]1c(-n2c3[c-]c(-c4ccccn4)ccc3c3ccccc32)cccc1C(c1ccccc1)(c1ccccc1)c1ccccn1.[c-]1c(-n2c3[c-]c(-c4ccccn4)ccc3c3ccccc32)cccc1C1(c2ccccn2)c2ccccc2-c2ccccc21.

What is the InChIKey of 9-[3-(3,6-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]-2-pyridin-2-yl-1H-carbazol-1-ide;9-[3-[diphenyl(pyridin-2-yl)methyl]benzene-2-id-1-yl]-2-pyridin-2-yl-1H-carbazol-1-ide;pentakis(palladium(2+));2-pyridin-2-yl-9-[3-(9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(2-pyridin-2-ylpropan-2-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(2,2,4,4-tetramethyl-3-pyridin-2-ylpentan-3-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide?

The InChIKey is NASOETVPYLKXIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C49H41N3.C41H25N3.C41H27N3.C37H35N3.C31H23N3.5Pd/c1-47(2,3)33-21-24-41-39(30-33)40-31-34(48(4,5)6)22-25-42(40)49(41,46-19-10-12-27-51-46)35-14-13-15-36(29-35)52-44-18-8-7-16-37(44)38-23-20-32(28-45(38)52)43-17-9-11-26-50-43;1-4-17-35-31(14-1)32-15-2-5-18-36(32)41(35,40-21-8-10-25-43-40)29-12-11-13-30(27-29)44-38-20-6-3-16-33(38)34-23-22-28(26-39(34)44)37-19-7-9-24-42-37;1-3-14-31(15-4-1)41(32-16-5-2-6-17-32,40-23-10-12-27-43-40)33-18-13-19-34(29-33)44-38-22-8-7-20-35(38)36-25-24-30(28-39(36)44)37-21-9-11-26-42-37;1-35(2,3)37(36(4,5)6,34-19-10-12-23-39-34)27-14-13-15-28(25-27)40-32-18-8-7-16-29(32)30-21-20-26(24-33(30)40)31-17-9-11-22-38-31;1-31(2,30-15-6-8-19-33-30)23-10-9-11-24(21-23)34-28-14-4-3-12-25(28)26-17-16-22(20-29(26)34)27-13-5-7-18-32-27;;;;;/h7-27,30-31H,1-6H3;1-25H;1-27H;7-23H,1-6H3;3-19H,1-2H3;;;;;/q5*-2;5*+2.

What are the key properties of 9-[3-(3,6-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]-2-pyridin-2-yl-1H-carbazol-1-ide;9-[3-[diphenyl(pyridin-2-yl)methyl]benzene-2-id-1-yl]-2-pyridin-2-yl-1H-carbazol-1-ide;pentakis(palladium(2+));2-pyridin-2-yl-9-[3-(9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(2-pyridin-2-ylpropan-2-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(2,2,4,4-tetramethyl-3-pyridin-2-ylpentan-3-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide?

9-[3-(3,6-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]-2-pyridin-2-yl-1H-carbazol-1-ide;9-[3-[diphenyl(pyridin-2-yl)methyl]benzene-2-id-1-yl]-2-pyridin-2-yl-1H-carbazol-1-ide;pentakis(palladium(2+));2-pyridin-2-yl-9-[3-(9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(2-pyridin-2-ylpropan-2-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(2,2,4,4-tetramethyl-3-pyridin-2-ylpentan-3-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide has a molecular weight of 3284.60 g/mol, XLogP of 46.60, 22 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.

Where does this data come from?

All data for 9-[3-(3,6-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]-2-pyridin-2-yl-1H-carbazol-1-ide;9-[3-[diphenyl(pyridin-2-yl)methyl]benzene-2-id-1-yl]-2-pyridin-2-yl-1H-carbazol-1-ide;pentakis(palladium(2+));2-pyridin-2-yl-9-[3-(9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(2-pyridin-2-ylpropan-2-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(2,2,4,4-tetramethyl-3-pyridin-2-ylpentan-3-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide is sourced from PubChem (CID 159217179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).