[4-(cyclohexylmethyl)-2,5-dideuterio-6-phenyl-3-pyridinyl]-trimethylsilane;[4-[cyclopentyl(dideuterio)methyl]-6-phenyl-3-pyridinyl]-trimethylsilane;(4-cyclopentyl-6-phenyl-3-pyridinyl)-trimethylsilane;5-(2-deuteriopropan-2-yl)-4-phenyl-2-phenylpyridine;5-(2-deuteriopropan-2-yl)-2-phenyl-4-[4-(trideuteriomethyl)phenyl]pyridine;[4-(3,3-dimethylbutan-2-yl)-6-phenyl-3-pyridinyl]-trimethylsilane;tetrakis(iridium);5-methyl-2-phenyl-4-(4-propan-2-ylphenyl)pyridine;4-phenyl-2-phenyl-5-(trideuteriomethyl)pyridine

C160H178Ir4N8Si4-8 — CID 157484012

IUPAC[4-(cyclohexylmethyl)-2,5-dideuterio-6-phenyl-3-pyridinyl]-trimethylsilane;[4-[cyclopentyl(dideuterio)methyl]-6-phenyl-3-pyridinyl]-trimethylsilane;(4-cyclopentyl-6-phenyl-3-pyridinyl)-trimethylsilane;5-(2-deuteriopropan-2-yl)-4-phenyl-2-phenylpyridine;5-(2-deuteriopropan-2-yl)-2-phenyl-4-[4-(trideuteriomethyl)phenyl]pyridine;[4-(3,3-dimethylbutan-2-yl)-6-phenyl-3-pyridinyl]-trimethylsilane;tetrakis(iridium);5-methyl-2-phenyl-4-(4-propan-2-ylphenyl)pyridine;4-phenyl-2-phenyl-5-(trideuteriomethyl)pyridine
SMILESCC(c1cc(-c2[c-]cccc2)ncc1[Si](C)(C)C)C(C)(C)C.C[Si](C)(C)c1cnc(-c2[c-]cccc2)cc1C1CCCC1.Cc1cnc(-c2[c-]cccc2)cc1-c1ccc(C(C)C)cc1.[2H]C(C)(C)c1cnc(-c2[c-]cccc2)cc1-c1ccccc1.[2H]C([2H])([2H])c1ccc(-c2cc(-c3[c-]cccc3)ncc2C([2H])(C)C)cc1.[2H]C([2H])([2H])c1cnc(-c2[c-]cccc2)cc1-c1ccccc1.[2H]C([2H])(c1cc(-c2[c-]cccc2)ncc1[Si](C)(C)C)C1CCCC1.[2H]c1nc(-c2[c-]cccc2)c([2H])c(CC2CCCCC2)c1[Si](C)(C)C.[Ir].[Ir].[Ir].[Ir]
InChIInChI=1S/C21H28NSi.2C21H20N.C20H26NSi.C20H28NSi.C20H18N.C19H24NSi.C18H14N.4Ir/c1-23(2,3)21-16-22-20(18-12-8-5-9-13-18)15-19(21)14-17-10-6-4-7-11-17;1-15(2)17-9-11-18(12-10-17)20-13-21(22-14-16(20)3)19-7-5-4-6-8-19;1-15(2)20-14-22-21(18-7-5-4-6-8-18)13-19(20)17-11-9-16(3)10-12-17;1-22(2,3)20-15-21-19(17-11-5-4-6-12-17)14-18(20)13-16-9-7-8-10-16;1-15(20(2,3)4)17-13-18(16-11-9-8-10-12-16)21-14-19(17)22(5,6)7;1-15(2)19-14-21-20(17-11-7-4-8-12-17)13-18(19)16-9-5-3-6-10-16;1-21(2,3)19-14-20-18(16-11-5-4-6-12-16)13-17(19)15-9-7-8-10-15;1-14-13-19-18(16-10-6-3-7-11-16)12-17(14)15-8-4-2-5-9-15;;;;/h5,8-9,12,15-17H,4,6-7,10-11,14H2,1-3H3;2*4-7,9-15H,1-3H3;4-6,11,14-16H,7-10,13H2,1-3H3;8-11,13-15H,1-7H3;3-11,13-15H,1-2H3;4-6,11,13-15H,7-10H2,1-3H3;2-10,12-13H,1H3;;;;/q8*-1;;;;/i15D,16D;;3D3,15D;13D2;;15D;;1D3;;;;
InChIKeyOVWUYOPKSPDORA-YHQYJKRPSA-N
MW3106.53 g/mol
LogP41.19
Rot. Bonds27

About [4-(cyclohexylmethyl)-2,5-dideuterio-6-phenyl-3-pyridinyl]-trimethylsilane;[4-[cyclopentyl(dideuterio)methyl]-6-phenyl-3-pyridinyl]-trimethylsilane;(4-cyclopentyl-6-phenyl-3-pyridinyl)-trimethylsilane;5-(2-deuteriopropan-2-yl)-4-phenyl-2-phenylpyridine;5-(2-deuteriopropan-2-yl)-2-phenyl-4-[4-(trideuteriomethyl)phenyl]pyridine;[4-(3,3-dimethylbutan-2-yl)-6-phenyl-3-pyridinyl]-trimethylsilane;tetrakis(iridium);5-methyl-2-phenyl-4-(4-propan-2-ylphenyl)pyridine;4-phenyl-2-phenyl-5-(trideuteriomethyl)pyridine

[4-(cyclohexylmethyl)-2,5-dideuterio-6-phenyl-3-pyridinyl]-trimethylsilane;[4-[cyclopentyl(dideuterio)methyl]-6-phenyl-3-pyridinyl]-trimethylsilane;(4-cyclopentyl-6-phenyl-3-pyridinyl)-trimethylsilane;5-(2-deuteriopropan-2-yl)-4-phenyl-2-phenylpyridine;5-(2-deuteriopropan-2-yl)-2-phenyl-4-[4-(trideuteriomethyl)phenyl]pyridine;[4-(3,3-dimethylbutan-2-yl)-6-phenyl-3-pyridinyl]-trimethylsilane;tetrakis(iridium);5-methyl-2-phenyl-4-(4-propan-2-ylphenyl)pyridine;4-phenyl-2-phenyl-5-(trideuteriomethyl)pyridine (PubChem CID 157484012) has the molecular formula C160H178Ir4N8Si4-8 and a molecular weight of 3106.53 g/mol. Its IUPAC name is [4-(cyclohexylmethyl)-2,5-dideuterio-6-phenyl-3-pyridinyl]-trimethylsilane;[4-[cyclopentyl(dideuterio)methyl]-6-phenyl-3-pyridinyl]-trimethylsilane;(4-cyclopentyl-6-phenyl-3-pyridinyl)-trimethylsilane;5-(2-deuteriopropan-2-yl)-4-phenyl-2-phenylpyridine;5-(2-deuteriopropan-2-yl)-2-phenyl-4-[4-(trideuteriomethyl)phenyl]pyridine;[4-(3,3-dimethylbutan-2-yl)-6-phenyl-3-pyridinyl]-trimethylsilane;tetrakis(iridium);5-methyl-2-phenyl-4-(4-propan-2-ylphenyl)pyridine;4-phenyl-2-phenyl-5-(trideuteriomethyl)pyridine.

Molecular Properties

Compound Name[4-(cyclohexylmethyl)-2,5-dideuterio-6-phenyl-3-pyridinyl]-trimethylsilane;[4-[cyclopentyl(dideuterio)methyl]-6-phenyl-3-pyridinyl]-trimethylsilane;(4-cyclopentyl-6-phenyl-3-pyridinyl)-trimethylsilane;5-(2-deuteriopropan-2-yl)-4-phenyl-2-phenylpyridine;5-(2-deuteriopropan-2-yl)-2-phenyl-4-[4-(trideuteriomethyl)phenyl]pyridine;[4-(3,3-dimethylbutan-2-yl)-6-phenyl-3-pyridinyl]-trimethylsilane;tetrakis(iridium);5-methyl-2-phenyl-4-(4-propan-2-ylphenyl)pyridine;4-phenyl-2-phenyl-5-(trideuteriomethyl)pyridine
PubChem CID157484012
Molecular FormulaC160H178Ir4N8Si4-8
Molecular Weight3106.53 g/mol
Exact Mass3107.26
IUPAC Name[4-(cyclohexylmethyl)-2,5-dideuterio-6-phenyl-3-pyridinyl]-trimethylsilane;[4-[cyclopentyl(dideuterio)methyl]-6-phenyl-3-pyridinyl]-trimethylsilane;(4-cyclopentyl-6-phenyl-3-pyridinyl)-trimethylsilane;5-(2-deuteriopropan-2-yl)-4-phenyl-2-phenylpyridine;5-(2-deuteriopropan-2-yl)-2-phenyl-4-[4-(trideuteriomethyl)phenyl]pyridine;[4-(3,3-dimethylbutan-2-yl)-6-phenyl-3-pyridinyl]-trimethylsilane;tetrakis(iridium);5-methyl-2-phenyl-4-(4-propan-2-ylphenyl)pyridine;4-phenyl-2-phenyl-5-(trideuteriomethyl)pyridine
SMILESCC(c1cc(-c2[c-]cccc2)ncc1[Si](C)(C)C)C(C)(C)C.C[Si](C)(C)c1cnc(-c2[c-]cccc2)cc1C1CCCC1.Cc1cnc(-c2[c-]cccc2)cc1-c1ccc(C(C)C)cc1.[2H]C(C)(C)c1cnc(-c2[c-]cccc2)cc1-c1ccccc1.[2H]C([2H])([2H])c1ccc(-c2cc(-c3[c-]cccc3)ncc2C([2H])(C)C)cc1.[2H]C([2H])([2H])c1cnc(-c2[c-]cccc2)cc1-c1ccccc1.[2H]C([2H])(c1cc(-c2[c-]cccc2)ncc1[Si](C)(C)C)C1CCCC1.[2H]c1nc(-c2[c-]cccc2)c([2H])c(CC2CCCCC2)c1[Si](C)(C)C.[Ir].[Ir].[Ir].[Ir]
InChIInChI=1S/C21H28NSi.2C21H20N.C20H26NSi.C20H28NSi.C20H18N.C19H24NSi.C18H14N.4Ir/c1-23(2,3)21-16-22-20(18-12-8-5-9-13-18)15-19(21)14-17-10-6-4-7-11-17;1-15(2)17-9-11-18(12-10-17)20-13-21(22-14-16(20)3)19-7-5-4-6-8-19;1-15(2)20-14-22-21(18-7-5-4-6-8-18)13-19(20)17-11-9-16(3)10-12-17;1-22(2,3)20-15-21-19(17-11-5-4-6-12-17)14-18(20)13-16-9-7-8-10-16;1-15(20(2,3)4)17-13-18(16-11-9-8-10-12-16)21-14-19(17)22(5,6)7;1-15(2)19-14-21-20(17-11-7-4-8-12-17)13-18(19)16-9-5-3-6-10-16;1-21(2,3)19-14-20-18(16-11-5-4-6-12-16)13-17(19)15-9-7-8-10-15;1-14-13-19-18(16-10-6-3-7-11-16)12-17(14)15-8-4-2-5-9-15;;;;/h5,8-9,12,15-17H,4,6-7,10-11,14H2,1-3H3;2*4-7,9-15H,1-3H3;4-6,11,14-16H,7-10,13H2,1-3H3;8-11,13-15H,1-7H3;3-11,13-15H,1-2H3;4-6,11,13-15H,7-10H2,1-3H3;2-10,12-13H,1H3;;;;/q8*-1;;;;/i15D,16D;;3D3,15D;13D2;;15D;;1D3;;;;
InChIKeyOVWUYOPKSPDORA-YHQYJKRPSA-N
XLogP41.19
TPSA103.12 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds27
Heavy Atoms176
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5003106.53
LogP ≤ 541.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

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

Analyze [4-(cyclohexylmethyl)-2,5-dideuterio-6-phenyl-3-pyridinyl]-trimethylsilane;[4-[cyclopentyl(dideuterio)methyl]-6-phenyl-3-pyridinyl]-trimethylsilane;(4-cyclopentyl-6-phenyl-3-pyridinyl)-trimethylsilane;5-(2-deuteriopropan-2-yl)-4-phenyl-2-phenylpyridine;5-(2-deuteriopropan-2-yl)-2-phenyl-4-[4-(trideuteriomethyl)phenyl]pyridine;[4-(3,3-dimethylbutan-2-yl)-6-phenyl-3-pyridinyl]-trimethylsilane;tetrakis(iridium);5-methyl-2-phenyl-4-(4-propan-2-ylphenyl)pyridine;4-phenyl-2-phenyl-5-(trideuteriomethyl)pyridine with MolForge

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Related Compounds

[4-(cyclohexylmethyl)-6-phenyl-3-pyridinyl]-trimethylsilane;5-(1-cyclopentylethyl)-2-(6-methyl-2H-pyridin-2-id-3-yl)-4-phenylpyridine;[4-(1-cyclopentylethyl)-6-phenyl-3-pyridinyl]-trimethylsilane;[4-(cyclopentylmethyl)-6-phenyl-3-pyridinyl]-trimethylsilane;(4-cyclopentyl-6-phenyl-3-pyridinyl)-trimethylsilane;tetrakis(iridium);5-methyl-4-phenyl-2-(2H-pyridin-2-id-3-yl)pyridine;5-methyl-4-phenyl-2-(3H-pyridin-3-id-4-yl)pyridine;2-phenyl-4-(4-phenyl-5-propan-2-yl-2-pyridinyl)-5H-pyrimidin-5-ide
CID 158177734
(4-cyclopentyl-6-phenyl-3-pyridinyl)-trimethylsilane;iridium
CID 140739402
[4-cyclopentyl-6-(2H-naphthalen-2-id-1-yl)-3-pyridinyl]-trimethylsilane;pentakis(iridium);methyl-(4-methyl-6-phenyl-3-pyridinyl)-bis(trideuteriomethyl)silane;trimethyl-[4-(2-methylpropyl)-6-(2H-naphthalen-2-id-1-yl)-3-pyridinyl]silane;trimethyl-[6-(2H-naphthalen-2-id-1-yl)-4-phenyl-3-pyridinyl]silane;trimethyl-[6-(2H-naphthalen-2-id-1-yl)-2-propan-2-yl-3-pyridinyl]silane
CID 159646597
[4-(cyclohexylmethyl)-6-phenyl-3-pyridinyl]-trimethylsilane;[4-(1-cyclopentylethyl)-6-phenyl-3-pyridinyl]-trimethylsilane;[4-(cyclopentylmethyl)-6-phenyl-3-pyridinyl]-trimethylsilane;(4-cyclopentyl-6-phenyl-3-pyridinyl)-trimethylsilane;2-(4H-dibenzothiophen-4-id-3-yl)-5-methyl-4-(4-propan-2-ylphenyl)pyridine;tetrakis(iridium);5-methyl-2-(7-methyl-3H-dibenzofuran-3-id-4-yl)-4-phenylpyridine;2-(2H-phenanthren-2-id-1-yl)-4-phenyl-5-propan-2-ylpyridine;4-phenyl-2-(9-phenyl-2,9-dihydrofluoren-2-id-3-yl)-5-propan-2-ylpyridine
CID 161160695
[4-butan-2-yl-6-(3-phenylbenzene-6-id-1-yl)-3-pyridinyl]-trimethylsilane;[4-cyclopentyl-6-(3,5-dimethylbenzene-6-id-1-yl)-3-pyridinyl]-trimethylsilane;pentakis(iridium);trimethyl-[4-methyl-6-(3-phenylbenzene-6-id-1-yl)-3-pyridinyl]silane;trimethyl-[4-(2-methylpropyl)-6-(3-phenylbenzene-6-id-1-yl)-3-pyridinyl]silane;trimethyl-[6-(3-phenylbenzene-6-id-1-yl)-4-propan-2-yl-3-pyridinyl]silane;pentakis(trimethyl-(6-phenyl-3-pyridinyl)silane)
CID 161316211
[4-[cyclopentyl(dideuterio)methyl]-6-phenyl-3-pyridinyl]-trimethylsilane;8-[4-(1,1-dideuterio-2,2-dimethylpropyl)-5-(trideuteriomethyl)-2-pyridinyl]-2-(trideuteriomethyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;iridium
CID 155611208
4-[cyclohexyl(dideuterio)methyl]-2-[3-[2-(4-methylphenyl)propan-2-yl]benzene-6-id-1-yl]pyridine;4-[cyclohexyl(dideuterio)methyl]-2-phenyl-5-(trideuteriomethyl)pyridine;bis(4-(2-deuteriopropan-2-yl)-2-[3-(2-phenylpropan-2-yl)benzene-6-id-1-yl]pyridine);4-fluoro-2-[3-(2-phenylpropan-2-yl)benzene-6-id-1-yl]pyridine;tetrakis(iridium);4-phenyl-2-phenyl-5-(trideuteriomethyl)pyridine;trimethyl-(6-phenyl-3-pyridinyl)silane;trimethyl-[6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]germane
CID 163774129
[4-[cyclohexyl(dideuterio)methyl]-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]-trimethylsilane;[4-(cyclohexylmethyl)-6-phenyl-3-pyridinyl]-trimethylsilane;[4-[cyclopentyl(dideuterio)methyl]-6-(3-methylbenzene-6-id-1-yl)-3-pyridinyl]-trimethylsilane;[4-(cyclopentylmethyl)-6-phenyl-3-pyridinyl]-trimethylsilane;tetrakis(iridium);bis(2-methyl-6-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide);bis(2-methyl-6-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-7H-[1]benzothiolo[2,3-b]pyridin-7-ide)
CID 159229917
8-[4-(cyclopentylmethyl)-5-propan-2-yl-2-pyridinyl]-2,4-dimethyl-7H-[1]benzofuro[2,3-b]pyridin-7-ide;iridium;trimethyl-(6-phenyl-4-propan-2-yl-3-pyridinyl)silane
CID 155610713
6-[4-[cyclohexyl(dideuterio)methyl]-2-pyridinyl]-2-phenyl-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[4-(2-deuteriopropan-2-yl)-6-phenyl-3-pyridinyl]-trimethylsilane;iridium
CID 169039393
[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
4-[cyclopentyl(dideuterio)methyl]-2-(7-phenyl-3H-dibenzofuran-3-id-4-yl)pyridine;[4-(2-deuteriopropan-2-yl)-6-phenyl-3-pyridinyl]-trimethylsilane;iridium
CID 166576585

Frequently Asked Questions

What is the IUPAC name of [4-(cyclohexylmethyl)-2,5-dideuterio-6-phenyl-3-pyridinyl]-trimethylsilane;[4-[cyclopentyl(dideuterio)methyl]-6-phenyl-3-pyridinyl]-trimethylsilane;(4-cyclopentyl-6-phenyl-3-pyridinyl)-trimethylsilane;5-(2-deuteriopropan-2-yl)-4-phenyl-2-phenylpyridine;5-(2-deuteriopropan-2-yl)-2-phenyl-4-[4-(trideuteriomethyl)phenyl]pyridine;[4-(3,3-dimethylbutan-2-yl)-6-phenyl-3-pyridinyl]-trimethylsilane;tetrakis(iridium);5-methyl-2-phenyl-4-(4-propan-2-ylphenyl)pyridine;4-phenyl-2-phenyl-5-(trideuteriomethyl)pyridine?
The IUPAC name of [4-(cyclohexylmethyl)-2,5-dideuterio-6-phenyl-3-pyridinyl]-trimethylsilane;[4-[cyclopentyl(dideuterio)methyl]-6-phenyl-3-pyridinyl]-trimethylsilane;(4-cyclopentyl-6-phenyl-3-pyridinyl)-trimethylsilane;5-(2-deuteriopropan-2-yl)-4-phenyl-2-phenylpyridine;5-(2-deuteriopropan-2-yl)-2-phenyl-4-[4-(trideuteriomethyl)phenyl]pyridine;[4-(3,3-dimethylbutan-2-yl)-6-phenyl-3-pyridinyl]-trimethylsilane;tetrakis(iridium);5-methyl-2-phenyl-4-(4-propan-2-ylphenyl)pyridine;4-phenyl-2-phenyl-5-(trideuteriomethyl)pyridine (CID 157484012) is [4-(cyclohexylmethyl)-2,5-dideuterio-6-phenyl-3-pyridinyl]-trimethylsilane;[4-[cyclopentyl(dideuterio)methyl]-6-phenyl-3-pyridinyl]-trimethylsilane;(4-cyclopentyl-6-phenyl-3-pyridinyl)-trimethylsilane;5-(2-deuteriopropan-2-yl)-4-phenyl-2-phenylpyridine;5-(2-deuteriopropan-2-yl)-2-phenyl-4-[4-(trideuteriomethyl)phenyl]pyridine;[4-(3,3-dimethylbutan-2-yl)-6-phenyl-3-pyridinyl]-trimethylsilane;tetrakis(iridium);5-methyl-2-phenyl-4-(4-propan-2-ylphenyl)pyridine;4-phenyl-2-phenyl-5-(trideuteriomethyl)pyridine.
What is the SMILES notation for [4-(cyclohexylmethyl)-2,5-dideuterio-6-phenyl-3-pyridinyl]-trimethylsilane;[4-[cyclopentyl(dideuterio)methyl]-6-phenyl-3-pyridinyl]-trimethylsilane;(4-cyclopentyl-6-phenyl-3-pyridinyl)-trimethylsilane;5-(2-deuteriopropan-2-yl)-4-phenyl-2-phenylpyridine;5-(2-deuteriopropan-2-yl)-2-phenyl-4-[4-(trideuteriomethyl)phenyl]pyridine;[4-(3,3-dimethylbutan-2-yl)-6-phenyl-3-pyridinyl]-trimethylsilane;tetrakis(iridium);5-methyl-2-phenyl-4-(4-propan-2-ylphenyl)pyridine;4-phenyl-2-phenyl-5-(trideuteriomethyl)pyridine?
The canonical SMILES for [4-(cyclohexylmethyl)-2,5-dideuterio-6-phenyl-3-pyridinyl]-trimethylsilane;[4-[cyclopentyl(dideuterio)methyl]-6-phenyl-3-pyridinyl]-trimethylsilane;(4-cyclopentyl-6-phenyl-3-pyridinyl)-trimethylsilane;5-(2-deuteriopropan-2-yl)-4-phenyl-2-phenylpyridine;5-(2-deuteriopropan-2-yl)-2-phenyl-4-[4-(trideuteriomethyl)phenyl]pyridine;[4-(3,3-dimethylbutan-2-yl)-6-phenyl-3-pyridinyl]-trimethylsilane;tetrakis(iridium);5-methyl-2-phenyl-4-(4-propan-2-ylphenyl)pyridine;4-phenyl-2-phenyl-5-(trideuteriomethyl)pyridine is CC(c1cc(-c2[c-]cccc2)ncc1[Si](C)(C)C)C(C)(C)C.C[Si](C)(C)c1cnc(-c2[c-]cccc2)cc1C1CCCC1.Cc1cnc(-c2[c-]cccc2)cc1-c1ccc(C(C)C)cc1.[2H]C(C)(C)c1cnc(-c2[c-]cccc2)cc1-c1ccccc1.[2H]C([2H])([2H])c1ccc(-c2cc(-c3[c-]cccc3)ncc2C([2H])(C)C)cc1.[2H]C([2H])([2H])c1cnc(-c2[c-]cccc2)cc1-c1ccccc1.[2H]C([2H])(c1cc(-c2[c-]cccc2)ncc1[Si](C)(C)C)C1CCCC1.[2H]c1nc(-c2[c-]cccc2)c([2H])c(CC2CCCCC2)c1[Si](C)(C)C.[Ir].[Ir].[Ir].[Ir].
What is the InChIKey of [4-(cyclohexylmethyl)-2,5-dideuterio-6-phenyl-3-pyridinyl]-trimethylsilane;[4-[cyclopentyl(dideuterio)methyl]-6-phenyl-3-pyridinyl]-trimethylsilane;(4-cyclopentyl-6-phenyl-3-pyridinyl)-trimethylsilane;5-(2-deuteriopropan-2-yl)-4-phenyl-2-phenylpyridine;5-(2-deuteriopropan-2-yl)-2-phenyl-4-[4-(trideuteriomethyl)phenyl]pyridine;[4-(3,3-dimethylbutan-2-yl)-6-phenyl-3-pyridinyl]-trimethylsilane;tetrakis(iridium);5-methyl-2-phenyl-4-(4-propan-2-ylphenyl)pyridine;4-phenyl-2-phenyl-5-(trideuteriomethyl)pyridine?
The InChIKey is OVWUYOPKSPDORA-YHQYJKRPSA-N. The full InChI is InChI=1S/C21H28NSi.2C21H20N.C20H26NSi.C20H28NSi.C20H18N.C19H24NSi.C18H14N.4Ir/c1-23(2,3)21-16-22-20(18-12-8-5-9-13-18)15-19(21)14-17-10-6-4-7-11-17;1-15(2)17-9-11-18(12-10-17)20-13-21(22-14-16(20)3)19-7-5-4-6-8-19;1-15(2)20-14-22-21(18-7-5-4-6-8-18)13-19(20)17-11-9-16(3)10-12-17;1-22(2,3)20-15-21-19(17-11-5-4-6-12-17)14-18(20)13-16-9-7-8-10-16;1-15(20(2,3)4)17-13-18(16-11-9-8-10-12-16)21-14-19(17)22(5,6)7;1-15(2)19-14-21-20(17-11-7-4-8-12-17)13-18(19)16-9-5-3-6-10-16;1-21(2,3)19-14-20-18(16-11-5-4-6-12-16)13-17(19)15-9-7-8-10-15;1-14-13-19-18(16-10-6-3-7-11-16)12-17(14)15-8-4-2-5-9-15;;;;/h5,8-9,12,15-17H,4,6-7,10-11,14H2,1-3H3;2*4-7,9-15H,1-3H3;4-6,11,14-16H,7-10,13H2,1-3H3;8-11,13-15H,1-7H3;3-11,13-15H,1-2H3;4-6,11,13-15H,7-10H2,1-3H3;2-10,12-13H,1H3;;;;/q8*-1;;;;/i15D,16D;;3D3,15D;13D2;;15D;;1D3;;;;.
What are the key properties of [4-(cyclohexylmethyl)-2,5-dideuterio-6-phenyl-3-pyridinyl]-trimethylsilane;[4-[cyclopentyl(dideuterio)methyl]-6-phenyl-3-pyridinyl]-trimethylsilane;(4-cyclopentyl-6-phenyl-3-pyridinyl)-trimethylsilane;5-(2-deuteriopropan-2-yl)-4-phenyl-2-phenylpyridine;5-(2-deuteriopropan-2-yl)-2-phenyl-4-[4-(trideuteriomethyl)phenyl]pyridine;[4-(3,3-dimethylbutan-2-yl)-6-phenyl-3-pyridinyl]-trimethylsilane;tetrakis(iridium);5-methyl-2-phenyl-4-(4-propan-2-ylphenyl)pyridine;4-phenyl-2-phenyl-5-(trideuteriomethyl)pyridine?
[4-(cyclohexylmethyl)-2,5-dideuterio-6-phenyl-3-pyridinyl]-trimethylsilane;[4-[cyclopentyl(dideuterio)methyl]-6-phenyl-3-pyridinyl]-trimethylsilane;(4-cyclopentyl-6-phenyl-3-pyridinyl)-trimethylsilane;5-(2-deuteriopropan-2-yl)-4-phenyl-2-phenylpyridine;5-(2-deuteriopropan-2-yl)-2-phenyl-4-[4-(trideuteriomethyl)phenyl]pyridine;[4-(3,3-dimethylbutan-2-yl)-6-phenyl-3-pyridinyl]-trimethylsilane;tetrakis(iridium);5-methyl-2-phenyl-4-(4-propan-2-ylphenyl)pyridine;4-phenyl-2-phenyl-5-(trideuteriomethyl)pyridine has a molecular weight of 3106.53 g/mol, XLogP of 41.19, 27 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(cyclohexylmethyl)-2,5-dideuterio-6-phenyl-3-pyridinyl]-trimethylsilane;[4-[cyclopentyl(dideuterio)methyl]-6-phenyl-3-pyridinyl]-trimethylsilane;(4-cyclopentyl-6-phenyl-3-pyridinyl)-trimethylsilane;5-(2-deuteriopropan-2-yl)-4-phenyl-2-phenylpyridine;5-(2-deuteriopropan-2-yl)-2-phenyl-4-[4-(trideuteriomethyl)phenyl]pyridine;[4-(3,3-dimethylbutan-2-yl)-6-phenyl-3-pyridinyl]-trimethylsilane;tetrakis(iridium);5-methyl-2-phenyl-4-(4-propan-2-ylphenyl)pyridine;4-phenyl-2-phenyl-5-(trideuteriomethyl)pyridine is sourced from PubChem (CID 157484012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).