N,N-diphenyl-4-[4'-[4-(N-phenylanilino)phenyl]-9,9'-spirobi[fluorene]-4-yl]aniline;heptakis(iridium);1-phenylisoquinoline;pentakis(2-phenylpyridine);2-phenylquinoline;trimethyl-[4-methyl-6-(3-phenylbenzene-6-id-1-yl)-3-pyridinyl]silane;tetrakis(trimethyl-(4-methyl-6-phenyl-3-pyridinyl)silane);trimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]silane;trimethyl-(4-phenyl-6-phenyl-3-pyridinyl)silane

C265H240Ir7N16Si7-14 — CID 159945106

About N,N-diphenyl-4-[4'-[4-(N-phenylanilino)phenyl]-9,9'-spirobi[fluorene]-4-yl]aniline;heptakis(iridium);1-phenylisoquinoline;pentakis(2-phenylpyridine);2-phenylquinoline;trimethyl-[4-methyl-6-(3-phenylbenzene-6-id-1-yl)-3-pyridinyl]silane;tetrakis(trimethyl-(4-methyl-6-phenyl-3-pyridinyl)silane);trimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]silane;trimethyl-(4-phenyl-6-phenyl-3-pyridinyl)silane

N,N-diphenyl-4-[4'-[4-(N-phenylanilino)phenyl]-9,9'-spirobi[fluorene]-4-yl]aniline;heptakis(iridium);1-phenylisoquinoline;pentakis(2-phenylpyridine);2-phenylquinoline;trimethyl-[4-methyl-6-(3-phenylbenzene-6-id-1-yl)-3-pyridinyl]silane;tetrakis(trimethyl-(4-methyl-6-phenyl-3-pyridinyl)silane);trimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]silane;trimethyl-(4-phenyl-6-phenyl-3-pyridinyl)silane (PubChem CID 159945106) has the molecular formula C265H240Ir7N16Si7-14 and a molecular weight of 5191.07 g/mol. Its IUPAC name is N,N-diphenyl-4-[4'-[4-(N-phenylanilino)phenyl]-9,9'-spirobi[fluorene]-4-yl]aniline;heptakis(iridium);1-phenylisoquinoline;pentakis(2-phenylpyridine);2-phenylquinoline;trimethyl-[4-methyl-6-(3-phenylbenzene-6-id-1-yl)-3-pyridinyl]silane;tetrakis(trimethyl-(4-methyl-6-phenyl-3-pyridinyl)silane);trimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]silane;trimethyl-(4-phenyl-6-phenyl-3-pyridinyl)silane.

Molecular Properties

• Compound Name: N,N-diphenyl-4-[4'-[4-(N-phenylanilino)phenyl]-9,9'-spirobi[fluorene]-4-yl]aniline;heptakis(iridium);1-phenylisoquinoline;pentakis(2-phenylpyridine);2-phenylquinoline;trimethyl-[4-methyl-6-(3-phenylbenzene-6-id-1-yl)-3-pyridinyl]silane;tetrakis(trimethyl-(4-methyl-6-phenyl-3-pyridinyl)silane);trimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]silane;trimethyl-(4-phenyl-6-phenyl-3-pyridinyl)silane
• PubChem CID: 159945106
• Molecular Formula: C265H240Ir7N16Si7-14
• Molecular Weight: 5191.07 g/mol
• Exact Mass: 5192.51
• IUPAC Name: N,N-diphenyl-4-[4'-[4-(N-phenylanilino)phenyl]-9,9'-spirobi[fluorene]-4-yl]aniline;heptakis(iridium);1-phenylisoquinoline;pentakis(2-phenylpyridine);2-phenylquinoline;trimethyl-[4-methyl-6-(3-phenylbenzene-6-id-1-yl)-3-pyridinyl]silane;tetrakis(trimethyl-(4-methyl-6-phenyl-3-pyridinyl)silane);trimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]silane;trimethyl-(4-phenyl-6-phenyl-3-pyridinyl)silane
• SMILES: CC(C)Cc1cc(-c2[c-]cccc2)ncc1[Si](C)(C)C.C[Si](C)(C)c1cnc(-c2[c-]cccc2)cc1-c1ccccc1.Cc1cc(-c2[c-]ccc(-c3ccccc3)c2)ncc1[Si](C)(C)C.Cc1cc(-c2[c-]cccc2)ncc1[Si](C)(C)C.Cc1cc(-c2[c-]cccc2)ncc1[Si](C)(C)C.Cc1cc(-c2[c-]cccc2)ncc1[Si](C)(C)C.Cc1cc(-c2[c-]cccc2)ncc1[Si](C)(C)C.[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[c-]1ccccc1-c1ccc2ccccc2n1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1nccc2ccccc12.c1ccc(N(c2ccccc2)c2ccc(-c3cccc4c3-c3ccccc3C43c4ccccc4-c4c(-c5ccc(N(c6ccccc6)c6ccccc6)cc5)cccc43)cc2)cc1
• InChI: InChI=1S/C61H42N2.C21H22NSi.C20H20NSi.C18H24NSi.4C15H18NSi.2C15H10N.5C11H8N.7Ir/c1-5-19-45(20-6-1)62(46-21-7-2-8-22-46)49-39-35-43(36-40-49)51-29-17-33-57-59(51)53-27-13-15-31-55(53)61(57)56-32-16-14-28-54(56)60-52(30-18-34-58(60)61)44-37-41-50(42-38-44)63(47-23-9-3-10-24-47)48-25-11-4-12-26-48;1-16-13-20(22-15-21(16)23(2,3)4)19-12-8-11-18(14-19)17-9-6-5-7-10-17;1-22(2,3)20-15-21-19(17-12-8-5-9-13-17)14-18(20)16-10-6-4-7-11-16;1-14(2)11-16-12-17(15-9-7-6-8-10-15)19-13-18(16)20(3,4)5;4*1-12-10-14(13-8-6-5-7-9-13)16-11-15(12)17(2,3)4;1-2-7-13(8-3-1)15-14-9-5-4-6-12(14)10-11-16-15;1-2-6-12(7-3-1)15-11-10-13-8-4-5-9-14(13)16-15;5*1-2-6-10(7-3-1)11-8-4-5-9-12-11;;;;;;;/h1-42H;5-11,13-15H,1-4H3;4-12,14-15H,1-3H3;6-9,12-14H,11H2,1-5H3;4*5-8,10-11H,1-4H3;1-7,9-11H;1-6,8-11H;5*1-6,8-9H;;;;;;;/q;14*-1
• InChIKey: CIWGTDUDHDNSOM-UHFFFAOYSA-N
• XLogP: 64.17
• TPSA: 186.94 Ų
• H-Bond Acceptors: 16
• Rotatable Bonds: 33
• Heavy Atoms: 295
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	5191.07
LogP ≤ 5	64.17
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	16

Frequently Asked Questions

What is the IUPAC name of N,N-diphenyl-4-[4'-[4-(N-phenylanilino)phenyl]-9,9'-spirobi[fluorene]-4-yl]aniline;heptakis(iridium);1-phenylisoquinoline;pentakis(2-phenylpyridine);2-phenylquinoline;trimethyl-[4-methyl-6-(3-phenylbenzene-6-id-1-yl)-3-pyridinyl]silane;tetrakis(trimethyl-(4-methyl-6-phenyl-3-pyridinyl)silane);trimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]silane;trimethyl-(4-phenyl-6-phenyl-3-pyridinyl)silane?

The IUPAC name of N,N-diphenyl-4-[4'-[4-(N-phenylanilino)phenyl]-9,9'-spirobi[fluorene]-4-yl]aniline;heptakis(iridium);1-phenylisoquinoline;pentakis(2-phenylpyridine);2-phenylquinoline;trimethyl-[4-methyl-6-(3-phenylbenzene-6-id-1-yl)-3-pyridinyl]silane;tetrakis(trimethyl-(4-methyl-6-phenyl-3-pyridinyl)silane);trimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]silane;trimethyl-(4-phenyl-6-phenyl-3-pyridinyl)silane (CID 159945106) is N,N-diphenyl-4-[4'-[4-(N-phenylanilino)phenyl]-9,9'-spirobi[fluorene]-4-yl]aniline;heptakis(iridium);1-phenylisoquinoline;pentakis(2-phenylpyridine);2-phenylquinoline;trimethyl-[4-methyl-6-(3-phenylbenzene-6-id-1-yl)-3-pyridinyl]silane;tetrakis(trimethyl-(4-methyl-6-phenyl-3-pyridinyl)silane);trimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]silane;trimethyl-(4-phenyl-6-phenyl-3-pyridinyl)silane.

What is the SMILES notation for N,N-diphenyl-4-[4'-[4-(N-phenylanilino)phenyl]-9,9'-spirobi[fluorene]-4-yl]aniline;heptakis(iridium);1-phenylisoquinoline;pentakis(2-phenylpyridine);2-phenylquinoline;trimethyl-[4-methyl-6-(3-phenylbenzene-6-id-1-yl)-3-pyridinyl]silane;tetrakis(trimethyl-(4-methyl-6-phenyl-3-pyridinyl)silane);trimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]silane;trimethyl-(4-phenyl-6-phenyl-3-pyridinyl)silane?

The canonical SMILES for N,N-diphenyl-4-[4'-[4-(N-phenylanilino)phenyl]-9,9'-spirobi[fluorene]-4-yl]aniline;heptakis(iridium);1-phenylisoquinoline;pentakis(2-phenylpyridine);2-phenylquinoline;trimethyl-[4-methyl-6-(3-phenylbenzene-6-id-1-yl)-3-pyridinyl]silane;tetrakis(trimethyl-(4-methyl-6-phenyl-3-pyridinyl)silane);trimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]silane;trimethyl-(4-phenyl-6-phenyl-3-pyridinyl)silane is CC(C)Cc1cc(-c2[c-]cccc2)ncc1[Si](C)(C)C.C[Si](C)(C)c1cnc(-c2[c-]cccc2)cc1-c1ccccc1.Cc1cc(-c2[c-]ccc(-c3ccccc3)c2)ncc1[Si](C)(C)C.Cc1cc(-c2[c-]cccc2)ncc1[Si](C)(C)C.Cc1cc(-c2[c-]cccc2)ncc1[Si](C)(C)C.Cc1cc(-c2[c-]cccc2)ncc1[Si](C)(C)C.Cc1cc(-c2[c-]cccc2)ncc1[Si](C)(C)C.[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[c-]1ccccc1-c1ccc2ccccc2n1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1nccc2ccccc12.c1ccc(N(c2ccccc2)c2ccc(-c3cccc4c3-c3ccccc3C43c4ccccc4-c4c(-c5ccc(N(c6ccccc6)c6ccccc6)cc5)cccc43)cc2)cc1.

What is the InChIKey of N,N-diphenyl-4-[4'-[4-(N-phenylanilino)phenyl]-9,9'-spirobi[fluorene]-4-yl]aniline;heptakis(iridium);1-phenylisoquinoline;pentakis(2-phenylpyridine);2-phenylquinoline;trimethyl-[4-methyl-6-(3-phenylbenzene-6-id-1-yl)-3-pyridinyl]silane;tetrakis(trimethyl-(4-methyl-6-phenyl-3-pyridinyl)silane);trimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]silane;trimethyl-(4-phenyl-6-phenyl-3-pyridinyl)silane?

The InChIKey is CIWGTDUDHDNSOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C61H42N2.C21H22NSi.C20H20NSi.C18H24NSi.4C15H18NSi.2C15H10N.5C11H8N.7Ir/c1-5-19-45(20-6-1)62(46-21-7-2-8-22-46)49-39-35-43(36-40-49)51-29-17-33-57-59(51)53-27-13-15-31-55(53)61(57)56-32-16-14-28-54(56)60-52(30-18-34-58(60)61)44-37-41-50(42-38-44)63(47-23-9-3-10-24-47)48-25-11-4-12-26-48;1-16-13-20(22-15-21(16)23(2,3)4)19-12-8-11-18(14-19)17-9-6-5-7-10-17;1-22(2,3)20-15-21-19(17-12-8-5-9-13-17)14-18(20)16-10-6-4-7-11-16;1-14(2)11-16-12-17(15-9-7-6-8-10-15)19-13-18(16)20(3,4)5;4*1-12-10-14(13-8-6-5-7-9-13)16-11-15(12)17(2,3)4;1-2-7-13(8-3-1)15-14-9-5-4-6-12(14)10-11-16-15;1-2-6-12(7-3-1)15-11-10-13-8-4-5-9-14(13)16-15;5*1-2-6-10(7-3-1)11-8-4-5-9-12-11;;;;;;;/h1-42H;5-11,13-15H,1-4H3;4-12,14-15H,1-3H3;6-9,12-14H,11H2,1-5H3;4*5-8,10-11H,1-4H3;1-7,9-11H;1-6,8-11H;5*1-6,8-9H;;;;;;;/q;14*-1;;;;;;;.

What are the key properties of N,N-diphenyl-4-[4'-[4-(N-phenylanilino)phenyl]-9,9'-spirobi[fluorene]-4-yl]aniline;heptakis(iridium);1-phenylisoquinoline;pentakis(2-phenylpyridine);2-phenylquinoline;trimethyl-[4-methyl-6-(3-phenylbenzene-6-id-1-yl)-3-pyridinyl]silane;tetrakis(trimethyl-(4-methyl-6-phenyl-3-pyridinyl)silane);trimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]silane;trimethyl-(4-phenyl-6-phenyl-3-pyridinyl)silane?

N,N-diphenyl-4-[4'-[4-(N-phenylanilino)phenyl]-9,9'-spirobi[fluorene]-4-yl]aniline;heptakis(iridium);1-phenylisoquinoline;pentakis(2-phenylpyridine);2-phenylquinoline;trimethyl-[4-methyl-6-(3-phenylbenzene-6-id-1-yl)-3-pyridinyl]silane;tetrakis(trimethyl-(4-methyl-6-phenyl-3-pyridinyl)silane);trimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]silane;trimethyl-(4-phenyl-6-phenyl-3-pyridinyl)silane has a molecular weight of 5191.07 g/mol, XLogP of 64.17, 33 rotatable bonds, 0 hydrogen bond donors, and 16 hydrogen bond acceptors.

Where does this data come from?

All data for N,N-diphenyl-4-[4'-[4-(N-phenylanilino)phenyl]-9,9'-spirobi[fluorene]-4-yl]aniline;heptakis(iridium);1-phenylisoquinoline;pentakis(2-phenylpyridine);2-phenylquinoline;trimethyl-[4-methyl-6-(3-phenylbenzene-6-id-1-yl)-3-pyridinyl]silane;tetrakis(trimethyl-(4-methyl-6-phenyl-3-pyridinyl)silane);trimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]silane;trimethyl-(4-phenyl-6-phenyl-3-pyridinyl)silane is sourced from PubChem (CID 159945106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).