[4-(3,3-dimethylbutan-2-yl)-6-phenyl-3-pyridinyl]-trimethylsilane;[4-(2,2-dimethylpropyl)-6-phenyl-3-pyridinyl]-trimethylsilane;(4-ethyl-6-phenyl-3-pyridinyl)-trimethylsilane;pentakis(iridium);trimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]silane;pentakis(trimethyl-(4-phenyl-6-phenyl-3-pyridinyl)silane);trimethyl-(6-phenyl-4-propan-2-yl-3-pyridinyl)silane

C190H220Ir5N10Si10-10 — CID 158969029

IUPAC[4-(3,3-dimethylbutan-2-yl)-6-phenyl-3-pyridinyl]-trimethylsilane;[4-(2,2-dimethylpropyl)-6-phenyl-3-pyridinyl]-trimethylsilane;(4-ethyl-6-phenyl-3-pyridinyl)-trimethylsilane;pentakis(iridium);trimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]silane;pentakis(trimethyl-(4-phenyl-6-phenyl-3-pyridinyl)silane);trimethyl-(6-phenyl-4-propan-2-yl-3-pyridinyl)silane
SMILESCC(C)(C)Cc1cc(-c2[c-]cccc2)ncc1[Si](C)(C)C.CC(C)Cc1cc(-c2[c-]cccc2)ncc1[Si](C)(C)C.CC(C)c1cc(-c2[c-]cccc2)ncc1[Si](C)(C)C.CC(c1cc(-c2[c-]cccc2)ncc1[Si](C)(C)C)C(C)(C)C.CCc1cc(-c2[c-]cccc2)ncc1[Si](C)(C)C.C[Si](C)(C)c1cnc(-c2[c-]cccc2)cc1-c1ccccc1.C[Si](C)(C)c1cnc(-c2[c-]cccc2)cc1-c1ccccc1.C[Si](C)(C)c1cnc(-c2[c-]cccc2)cc1-c1ccccc1.C[Si](C)(C)c1cnc(-c2[c-]cccc2)cc1-c1ccccc1.C[Si](C)(C)c1cnc(-c2[c-]cccc2)cc1-c1ccccc1.[Ir].[Ir].[Ir].[Ir].[Ir]
InChIInChI=1S/5C20H20NSi.C20H28NSi.C19H26NSi.C18H24NSi.C17H22NSi.C16H20NSi.5Ir/c5*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;1-15(20(2,3)4)17-13-18(16-11-9-8-10-12-16)21-14-19(17)22(5,6)7;1-19(2,3)13-16-12-17(15-10-8-7-9-11-15)20-14-18(16)21(4,5)6;1-14(2)11-16-12-17(15-9-7-6-8-10-15)19-13-18(16)20(3,4)5;1-13(2)15-11-16(14-9-7-6-8-10-14)18-12-17(15)19(3,4)5;1-5-13-11-15(14-9-7-6-8-10-14)17-12-16(13)18(2,3)4;;;;;/h5*4-12,14-15H,1-3H3;8-11,13-15H,1-7H3;7-10,12,14H,13H2,1-6H3;6-9,12-14H,11H2,1-5H3;6-9,11-13H,1-5H3;6-9,11-12H,5H2,1-4H3;;;;;/q10*-1;;;;;
InChIKeySEWBUKDMYPFPEQ-UHFFFAOYSA-N
MW3885.86 g/mol
LogP45.88
Rot. Bonds31

About [4-(3,3-dimethylbutan-2-yl)-6-phenyl-3-pyridinyl]-trimethylsilane;[4-(2,2-dimethylpropyl)-6-phenyl-3-pyridinyl]-trimethylsilane;(4-ethyl-6-phenyl-3-pyridinyl)-trimethylsilane;pentakis(iridium);trimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]silane;pentakis(trimethyl-(4-phenyl-6-phenyl-3-pyridinyl)silane);trimethyl-(6-phenyl-4-propan-2-yl-3-pyridinyl)silane

[4-(3,3-dimethylbutan-2-yl)-6-phenyl-3-pyridinyl]-trimethylsilane;[4-(2,2-dimethylpropyl)-6-phenyl-3-pyridinyl]-trimethylsilane;(4-ethyl-6-phenyl-3-pyridinyl)-trimethylsilane;pentakis(iridium);trimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]silane;pentakis(trimethyl-(4-phenyl-6-phenyl-3-pyridinyl)silane);trimethyl-(6-phenyl-4-propan-2-yl-3-pyridinyl)silane (PubChem CID 158969029) has the molecular formula C190H220Ir5N10Si10-10 and a molecular weight of 3885.86 g/mol. Its IUPAC name is [4-(3,3-dimethylbutan-2-yl)-6-phenyl-3-pyridinyl]-trimethylsilane;[4-(2,2-dimethylpropyl)-6-phenyl-3-pyridinyl]-trimethylsilane;(4-ethyl-6-phenyl-3-pyridinyl)-trimethylsilane;pentakis(iridium);trimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]silane;pentakis(trimethyl-(4-phenyl-6-phenyl-3-pyridinyl)silane);trimethyl-(6-phenyl-4-propan-2-yl-3-pyridinyl)silane.

Molecular Properties

Compound Name[4-(3,3-dimethylbutan-2-yl)-6-phenyl-3-pyridinyl]-trimethylsilane;[4-(2,2-dimethylpropyl)-6-phenyl-3-pyridinyl]-trimethylsilane;(4-ethyl-6-phenyl-3-pyridinyl)-trimethylsilane;pentakis(iridium);trimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]silane;pentakis(trimethyl-(4-phenyl-6-phenyl-3-pyridinyl)silane);trimethyl-(6-phenyl-4-propan-2-yl-3-pyridinyl)silane
PubChem CID158969029
Molecular FormulaC190H220Ir5N10Si10-10
Molecular Weight3885.86 g/mol
Exact Mass3886.34
IUPAC Name[4-(3,3-dimethylbutan-2-yl)-6-phenyl-3-pyridinyl]-trimethylsilane;[4-(2,2-dimethylpropyl)-6-phenyl-3-pyridinyl]-trimethylsilane;(4-ethyl-6-phenyl-3-pyridinyl)-trimethylsilane;pentakis(iridium);trimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]silane;pentakis(trimethyl-(4-phenyl-6-phenyl-3-pyridinyl)silane);trimethyl-(6-phenyl-4-propan-2-yl-3-pyridinyl)silane
SMILESCC(C)(C)Cc1cc(-c2[c-]cccc2)ncc1[Si](C)(C)C.CC(C)Cc1cc(-c2[c-]cccc2)ncc1[Si](C)(C)C.CC(C)c1cc(-c2[c-]cccc2)ncc1[Si](C)(C)C.CC(c1cc(-c2[c-]cccc2)ncc1[Si](C)(C)C)C(C)(C)C.CCc1cc(-c2[c-]cccc2)ncc1[Si](C)(C)C.C[Si](C)(C)c1cnc(-c2[c-]cccc2)cc1-c1ccccc1.C[Si](C)(C)c1cnc(-c2[c-]cccc2)cc1-c1ccccc1.C[Si](C)(C)c1cnc(-c2[c-]cccc2)cc1-c1ccccc1.C[Si](C)(C)c1cnc(-c2[c-]cccc2)cc1-c1ccccc1.C[Si](C)(C)c1cnc(-c2[c-]cccc2)cc1-c1ccccc1.[Ir].[Ir].[Ir].[Ir].[Ir]
InChIInChI=1S/5C20H20NSi.C20H28NSi.C19H26NSi.C18H24NSi.C17H22NSi.C16H20NSi.5Ir/c5*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;1-15(20(2,3)4)17-13-18(16-11-9-8-10-12-16)21-14-19(17)22(5,6)7;1-19(2,3)13-16-12-17(15-10-8-7-9-11-15)20-14-18(16)21(4,5)6;1-14(2)11-16-12-17(15-9-7-6-8-10-15)19-13-18(16)20(3,4)5;1-13(2)15-11-16(14-9-7-6-8-10-14)18-12-17(15)19(3,4)5;1-5-13-11-15(14-9-7-6-8-10-14)17-12-16(13)18(2,3)4;;;;;/h5*4-12,14-15H,1-3H3;8-11,13-15H,1-7H3;7-10,12,14H,13H2,1-6H3;6-9,12-14H,11H2,1-5H3;6-9,11-13H,1-5H3;6-9,11-12H,5H2,1-4H3;;;;;/q10*-1;;;;;
InChIKeySEWBUKDMYPFPEQ-UHFFFAOYSA-N
XLogP45.88
TPSA128.90 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds31
Heavy Atoms215
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5003885.86
LogP ≤ 545.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

Computed Properties (RDKit)

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

Analyze [4-(3,3-dimethylbutan-2-yl)-6-phenyl-3-pyridinyl]-trimethylsilane;[4-(2,2-dimethylpropyl)-6-phenyl-3-pyridinyl]-trimethylsilane;(4-ethyl-6-phenyl-3-pyridinyl)-trimethylsilane;pentakis(iridium);trimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]silane;pentakis(trimethyl-(4-phenyl-6-phenyl-3-pyridinyl)silane);trimethyl-(6-phenyl-4-propan-2-yl-3-pyridinyl)silane with MolForge

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Frequently Asked Questions

What is the IUPAC name of [4-(3,3-dimethylbutan-2-yl)-6-phenyl-3-pyridinyl]-trimethylsilane;[4-(2,2-dimethylpropyl)-6-phenyl-3-pyridinyl]-trimethylsilane;(4-ethyl-6-phenyl-3-pyridinyl)-trimethylsilane;pentakis(iridium);trimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]silane;pentakis(trimethyl-(4-phenyl-6-phenyl-3-pyridinyl)silane);trimethyl-(6-phenyl-4-propan-2-yl-3-pyridinyl)silane?
The IUPAC name of [4-(3,3-dimethylbutan-2-yl)-6-phenyl-3-pyridinyl]-trimethylsilane;[4-(2,2-dimethylpropyl)-6-phenyl-3-pyridinyl]-trimethylsilane;(4-ethyl-6-phenyl-3-pyridinyl)-trimethylsilane;pentakis(iridium);trimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]silane;pentakis(trimethyl-(4-phenyl-6-phenyl-3-pyridinyl)silane);trimethyl-(6-phenyl-4-propan-2-yl-3-pyridinyl)silane (CID 158969029) is [4-(3,3-dimethylbutan-2-yl)-6-phenyl-3-pyridinyl]-trimethylsilane;[4-(2,2-dimethylpropyl)-6-phenyl-3-pyridinyl]-trimethylsilane;(4-ethyl-6-phenyl-3-pyridinyl)-trimethylsilane;pentakis(iridium);trimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]silane;pentakis(trimethyl-(4-phenyl-6-phenyl-3-pyridinyl)silane);trimethyl-(6-phenyl-4-propan-2-yl-3-pyridinyl)silane.
What is the SMILES notation for [4-(3,3-dimethylbutan-2-yl)-6-phenyl-3-pyridinyl]-trimethylsilane;[4-(2,2-dimethylpropyl)-6-phenyl-3-pyridinyl]-trimethylsilane;(4-ethyl-6-phenyl-3-pyridinyl)-trimethylsilane;pentakis(iridium);trimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]silane;pentakis(trimethyl-(4-phenyl-6-phenyl-3-pyridinyl)silane);trimethyl-(6-phenyl-4-propan-2-yl-3-pyridinyl)silane?
The canonical SMILES for [4-(3,3-dimethylbutan-2-yl)-6-phenyl-3-pyridinyl]-trimethylsilane;[4-(2,2-dimethylpropyl)-6-phenyl-3-pyridinyl]-trimethylsilane;(4-ethyl-6-phenyl-3-pyridinyl)-trimethylsilane;pentakis(iridium);trimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]silane;pentakis(trimethyl-(4-phenyl-6-phenyl-3-pyridinyl)silane);trimethyl-(6-phenyl-4-propan-2-yl-3-pyridinyl)silane is CC(C)(C)Cc1cc(-c2[c-]cccc2)ncc1[Si](C)(C)C.CC(C)Cc1cc(-c2[c-]cccc2)ncc1[Si](C)(C)C.CC(C)c1cc(-c2[c-]cccc2)ncc1[Si](C)(C)C.CC(c1cc(-c2[c-]cccc2)ncc1[Si](C)(C)C)C(C)(C)C.CCc1cc(-c2[c-]cccc2)ncc1[Si](C)(C)C.C[Si](C)(C)c1cnc(-c2[c-]cccc2)cc1-c1ccccc1.C[Si](C)(C)c1cnc(-c2[c-]cccc2)cc1-c1ccccc1.C[Si](C)(C)c1cnc(-c2[c-]cccc2)cc1-c1ccccc1.C[Si](C)(C)c1cnc(-c2[c-]cccc2)cc1-c1ccccc1.C[Si](C)(C)c1cnc(-c2[c-]cccc2)cc1-c1ccccc1.[Ir].[Ir].[Ir].[Ir].[Ir].
What is the InChIKey of [4-(3,3-dimethylbutan-2-yl)-6-phenyl-3-pyridinyl]-trimethylsilane;[4-(2,2-dimethylpropyl)-6-phenyl-3-pyridinyl]-trimethylsilane;(4-ethyl-6-phenyl-3-pyridinyl)-trimethylsilane;pentakis(iridium);trimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]silane;pentakis(trimethyl-(4-phenyl-6-phenyl-3-pyridinyl)silane);trimethyl-(6-phenyl-4-propan-2-yl-3-pyridinyl)silane?
The InChIKey is SEWBUKDMYPFPEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/5C20H20NSi.C20H28NSi.C19H26NSi.C18H24NSi.C17H22NSi.C16H20NSi.5Ir/c5*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;1-15(20(2,3)4)17-13-18(16-11-9-8-10-12-16)21-14-19(17)22(5,6)7;1-19(2,3)13-16-12-17(15-10-8-7-9-11-15)20-14-18(16)21(4,5)6;1-14(2)11-16-12-17(15-9-7-6-8-10-15)19-13-18(16)20(3,4)5;1-13(2)15-11-16(14-9-7-6-8-10-14)18-12-17(15)19(3,4)5;1-5-13-11-15(14-9-7-6-8-10-14)17-12-16(13)18(2,3)4;;;;;/h5*4-12,14-15H,1-3H3;8-11,13-15H,1-7H3;7-10,12,14H,13H2,1-6H3;6-9,12-14H,11H2,1-5H3;6-9,11-13H,1-5H3;6-9,11-12H,5H2,1-4H3;;;;;/q10*-1;;;;;.
What are the key properties of [4-(3,3-dimethylbutan-2-yl)-6-phenyl-3-pyridinyl]-trimethylsilane;[4-(2,2-dimethylpropyl)-6-phenyl-3-pyridinyl]-trimethylsilane;(4-ethyl-6-phenyl-3-pyridinyl)-trimethylsilane;pentakis(iridium);trimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]silane;pentakis(trimethyl-(4-phenyl-6-phenyl-3-pyridinyl)silane);trimethyl-(6-phenyl-4-propan-2-yl-3-pyridinyl)silane?
[4-(3,3-dimethylbutan-2-yl)-6-phenyl-3-pyridinyl]-trimethylsilane;[4-(2,2-dimethylpropyl)-6-phenyl-3-pyridinyl]-trimethylsilane;(4-ethyl-6-phenyl-3-pyridinyl)-trimethylsilane;pentakis(iridium);trimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]silane;pentakis(trimethyl-(4-phenyl-6-phenyl-3-pyridinyl)silane);trimethyl-(6-phenyl-4-propan-2-yl-3-pyridinyl)silane has a molecular weight of 3885.86 g/mol, XLogP of 45.88, 31 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(3,3-dimethylbutan-2-yl)-6-phenyl-3-pyridinyl]-trimethylsilane;[4-(2,2-dimethylpropyl)-6-phenyl-3-pyridinyl]-trimethylsilane;(4-ethyl-6-phenyl-3-pyridinyl)-trimethylsilane;pentakis(iridium);trimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]silane;pentakis(trimethyl-(4-phenyl-6-phenyl-3-pyridinyl)silane);trimethyl-(6-phenyl-4-propan-2-yl-3-pyridinyl)silane is sourced from PubChem (CID 158969029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).