[6-(3H-dibenzofuran-3-id-2-yl)-3-pyridinyl]-trimethylsilane;[6-(1,3-dimethyl-7H-[1]benzofuro[2,3-c]pyridin-7-id-6-yl)-3-pyridinyl]-trimethylsilane;dimethyl-[6-(7-methyl-3H-dibenzofuran-3-id-2-yl)-3-pyridinyl]-phenylsilane;tris(4-hydroxypent-3-en-2-one);tris(iridium)

C82H85Ir3N4O9Si3-3 — CID 158963238

IUPAC[6-(3H-dibenzofuran-3-id-2-yl)-3-pyridinyl]-trimethylsilane;[6-(1,3-dimethyl-7H-[1]benzofuro[2,3-c]pyridin-7-id-6-yl)-3-pyridinyl]-trimethylsilane;dimethyl-[6-(7-methyl-3H-dibenzofuran-3-id-2-yl)-3-pyridinyl]-phenylsilane;tris(4-hydroxypent-3-en-2-one);tris(iridium)
SMILESCC(=O)C=C(C)O.CC(=O)C=C(C)O.CC(=O)C=C(C)O.C[Si](C)(C)c1ccc(-c2[c-]cc3oc4ccccc4c3c2)nc1.Cc1cc2c(oc3c[c-]c(-c4ccc([Si](C)(C)C)cn4)cc32)c(C)n1.Cc1ccc2c(c1)oc1c[c-]c(-c3ccc([Si](C)(C)c4ccccc4)cn3)cc12.[Ir].[Ir].[Ir]
InChIInChI=1S/C26H22NOSi.C21H21N2OSi.C20H18NOSi.3C5H8O2.3Ir/c1-18-9-12-22-23-16-19(10-14-25(23)28-26(22)15-18)24-13-11-21(17-27-24)29(2,3)20-7-5-4-6-8-20;1-13-10-18-17-11-15(6-9-20(17)24-21(18)14(2)23-13)19-8-7-16(12-22-19)25(3,4)5;1-23(2,3)15-9-10-18(21-13-15)14-8-11-20-17(12-14)16-6-4-5-7-19(16)22-20;3*1-4(6)3-5(2)7;;;/h4-9,11-17H,1-3H3;7-12H,1-5H3;4-7,9-13H,1-3H3;3*3,6H,1-2H3;;;/q3*-1;;;;;;
InChIKeySJDAWPCRPIOPBN-UHFFFAOYSA-N
MW1931.51 g/mol
LogP18.68
Rot. Bonds10

About [6-(3H-dibenzofuran-3-id-2-yl)-3-pyridinyl]-trimethylsilane;[6-(1,3-dimethyl-7H-[1]benzofuro[2,3-c]pyridin-7-id-6-yl)-3-pyridinyl]-trimethylsilane;dimethyl-[6-(7-methyl-3H-dibenzofuran-3-id-2-yl)-3-pyridinyl]-phenylsilane;tris(4-hydroxypent-3-en-2-one);tris(iridium)

[6-(3H-dibenzofuran-3-id-2-yl)-3-pyridinyl]-trimethylsilane;[6-(1,3-dimethyl-7H-[1]benzofuro[2,3-c]pyridin-7-id-6-yl)-3-pyridinyl]-trimethylsilane;dimethyl-[6-(7-methyl-3H-dibenzofuran-3-id-2-yl)-3-pyridinyl]-phenylsilane;tris(4-hydroxypent-3-en-2-one);tris(iridium) (PubChem CID 158963238) has the molecular formula C82H85Ir3N4O9Si3-3 and a molecular weight of 1931.51 g/mol. Its IUPAC name is [6-(3H-dibenzofuran-3-id-2-yl)-3-pyridinyl]-trimethylsilane;[6-(1,3-dimethyl-7H-[1]benzofuro[2,3-c]pyridin-7-id-6-yl)-3-pyridinyl]-trimethylsilane;dimethyl-[6-(7-methyl-3H-dibenzofuran-3-id-2-yl)-3-pyridinyl]-phenylsilane;tris(4-hydroxypent-3-en-2-one);tris(iridium).

Molecular Properties

Compound Name[6-(3H-dibenzofuran-3-id-2-yl)-3-pyridinyl]-trimethylsilane;[6-(1,3-dimethyl-7H-[1]benzofuro[2,3-c]pyridin-7-id-6-yl)-3-pyridinyl]-trimethylsilane;dimethyl-[6-(7-methyl-3H-dibenzofuran-3-id-2-yl)-3-pyridinyl]-phenylsilane;tris(4-hydroxypent-3-en-2-one);tris(iridium)
PubChem CID158963238
Molecular FormulaC82H85Ir3N4O9Si3-3
Molecular Weight1931.51 g/mol
Exact Mass1932.45
IUPAC Name[6-(3H-dibenzofuran-3-id-2-yl)-3-pyridinyl]-trimethylsilane;[6-(1,3-dimethyl-7H-[1]benzofuro[2,3-c]pyridin-7-id-6-yl)-3-pyridinyl]-trimethylsilane;dimethyl-[6-(7-methyl-3H-dibenzofuran-3-id-2-yl)-3-pyridinyl]-phenylsilane;tris(4-hydroxypent-3-en-2-one);tris(iridium)
SMILESCC(=O)C=C(C)O.CC(=O)C=C(C)O.CC(=O)C=C(C)O.C[Si](C)(C)c1ccc(-c2[c-]cc3oc4ccccc4c3c2)nc1.Cc1cc2c(oc3c[c-]c(-c4ccc([Si](C)(C)C)cn4)cc32)c(C)n1.Cc1ccc2c(c1)oc1c[c-]c(-c3ccc([Si](C)(C)c4ccccc4)cn3)cc12.[Ir].[Ir].[Ir]
InChIInChI=1S/C26H22NOSi.C21H21N2OSi.C20H18NOSi.3C5H8O2.3Ir/c1-18-9-12-22-23-16-19(10-14-25(23)28-26(22)15-18)24-13-11-21(17-27-24)29(2,3)20-7-5-4-6-8-20;1-13-10-18-17-11-15(6-9-20(17)24-21(18)14(2)23-13)19-8-7-16(12-22-19)25(3,4)5;1-23(2,3)15-9-10-18(21-13-15)14-8-11-20-17(12-14)16-6-4-5-7-19(16)22-20;3*1-4(6)3-5(2)7;;;/h4-9,11-17H,1-3H3;7-12H,1-5H3;4-7,9-13H,1-3H3;3*3,6H,1-2H3;;;/q3*-1;;;;;;
InChIKeySJDAWPCRPIOPBN-UHFFFAOYSA-N
XLogP18.68
TPSA202.88 Ų
H-Bond Donors3
H-Bond Acceptors13
Rotatable Bonds10
Heavy Atoms101
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001931.51
LogP ≤ 518.68
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1013

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Analyze [6-(3H-dibenzofuran-3-id-2-yl)-3-pyridinyl]-trimethylsilane;[6-(1,3-dimethyl-7H-[1]benzofuro[2,3-c]pyridin-7-id-6-yl)-3-pyridinyl]-trimethylsilane;dimethyl-[6-(7-methyl-3H-dibenzofuran-3-id-2-yl)-3-pyridinyl]-phenylsilane;tris(4-hydroxypent-3-en-2-one);tris(iridium) with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[6-(3H-dibenzofuran-3-id-2-yl)-3-pyridinyl]-trimethylsilane;4-hydroxypent-3-en-2-one;iridium
CID 161124870
[6-(2H-[1]benzofuro[2,3-b]pyridin-2-id-3-yl)-3-pyridinyl]-dimethyl-phenylsilane;[6-(1,3-dimethyl-7H-[1]benzofuro[2,3-c]pyridin-7-id-6-yl)-3-pyridinyl]-dimethyl-phenylsilane;dimethyl-[6-(7-methyl-3H-dibenzofuran-3-id-2-yl)-3-pyridinyl]-phenylsilane;tris(iridium);tris(2-phenylpyridine)
CID 160516375
[6-(2H-[1]benzofuro[2,3-b]pyridin-2-id-3-yl)-3-pyridinyl]-dimethyl-phenylsilane;[6-(1,3-dimethyl-7H-[1]benzofuro[2,3-c]pyridin-7-id-6-yl)-3-pyridinyl]-dimethyl-phenylsilane;dimethyl-[6-(2-methyl-7H-[1]benzofuro[2,3-b]pyridin-7-id-6-yl)-3-pyridinyl]-phenylsilane;tris(iridium);tris(2-phenylpyridine)
CID 159227979
2-(3H-dibenzofuran-3-id-2-yl)-5-methylpyridine;iridium
CID 58183919
CID 162498211
CID 162498211
[6-(1,3-dimethyl-[1]benzofuro[2,3-c]pyridin-6-yl)-4-(2-methylpropyl)-3-pyridinyl]-dimethyl-phenylsilane
CID 140719967
iridium;4-methyl-2-(7-phenyl-2H-dibenzofuran-2-id-3-yl)pyridine;trimethyl-(6-phenyl-3-pyridinyl)silane
CID 166578482
2-(3H-dibenzofuran-3-id-4-yl)-1,5,7-trimethylimidazo[4,5-b]pyridine;iridium;trimethyl-[6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]silane
CID 167355072
4-benzyl-2-(3H-dibenzofuran-3-id-4-yl)pyridine;iridium;trimethyl-[6-(4-methylbenzene-6-id-1-yl)-3-pyridinyl]silane
CID 162708359
tetrakis(4-hydroxypent-3-en-2-one);tetrakis(iridium);bis((4-isoquinolin-1-ylbenzene-5-id-1-yl)-trimethylsilane);methyl-[3-(4-methyl-2-pyridinyl)benzene-4-id-1-yl]silane;trimethyl-[4-(5-methyl-2-pyridinyl)benzene-5-id-1-yl]silane
CID 158064123
iridium;2-(7-naphthalen-1-yl-3H-dibenzofuran-3-id-2-yl)-4-phenylpyridine;trimethyl-[6-(3-phenylbenzene-6-id-1-yl)-3-pyridinyl]silane
CID 169038570
(Z)-4-hydroxypent-3-en-2-one;iridium;2-(4-methylphenyl)-5-(3-phenylbenzene-6-id-1-yl)furo[2,3-c]pyridine
CID 155626083

Frequently Asked Questions

What is the IUPAC name of [6-(3H-dibenzofuran-3-id-2-yl)-3-pyridinyl]-trimethylsilane;[6-(1,3-dimethyl-7H-[1]benzofuro[2,3-c]pyridin-7-id-6-yl)-3-pyridinyl]-trimethylsilane;dimethyl-[6-(7-methyl-3H-dibenzofuran-3-id-2-yl)-3-pyridinyl]-phenylsilane;tris(4-hydroxypent-3-en-2-one);tris(iridium)?
The IUPAC name of [6-(3H-dibenzofuran-3-id-2-yl)-3-pyridinyl]-trimethylsilane;[6-(1,3-dimethyl-7H-[1]benzofuro[2,3-c]pyridin-7-id-6-yl)-3-pyridinyl]-trimethylsilane;dimethyl-[6-(7-methyl-3H-dibenzofuran-3-id-2-yl)-3-pyridinyl]-phenylsilane;tris(4-hydroxypent-3-en-2-one);tris(iridium) (CID 158963238) is [6-(3H-dibenzofuran-3-id-2-yl)-3-pyridinyl]-trimethylsilane;[6-(1,3-dimethyl-7H-[1]benzofuro[2,3-c]pyridin-7-id-6-yl)-3-pyridinyl]-trimethylsilane;dimethyl-[6-(7-methyl-3H-dibenzofuran-3-id-2-yl)-3-pyridinyl]-phenylsilane;tris(4-hydroxypent-3-en-2-one);tris(iridium).
What is the SMILES notation for [6-(3H-dibenzofuran-3-id-2-yl)-3-pyridinyl]-trimethylsilane;[6-(1,3-dimethyl-7H-[1]benzofuro[2,3-c]pyridin-7-id-6-yl)-3-pyridinyl]-trimethylsilane;dimethyl-[6-(7-methyl-3H-dibenzofuran-3-id-2-yl)-3-pyridinyl]-phenylsilane;tris(4-hydroxypent-3-en-2-one);tris(iridium)?
The canonical SMILES for [6-(3H-dibenzofuran-3-id-2-yl)-3-pyridinyl]-trimethylsilane;[6-(1,3-dimethyl-7H-[1]benzofuro[2,3-c]pyridin-7-id-6-yl)-3-pyridinyl]-trimethylsilane;dimethyl-[6-(7-methyl-3H-dibenzofuran-3-id-2-yl)-3-pyridinyl]-phenylsilane;tris(4-hydroxypent-3-en-2-one);tris(iridium) is CC(=O)C=C(C)O.CC(=O)C=C(C)O.CC(=O)C=C(C)O.C[Si](C)(C)c1ccc(-c2[c-]cc3oc4ccccc4c3c2)nc1.Cc1cc2c(oc3c[c-]c(-c4ccc([Si](C)(C)C)cn4)cc32)c(C)n1.Cc1ccc2c(c1)oc1c[c-]c(-c3ccc([Si](C)(C)c4ccccc4)cn3)cc12.[Ir].[Ir].[Ir].
What is the InChIKey of [6-(3H-dibenzofuran-3-id-2-yl)-3-pyridinyl]-trimethylsilane;[6-(1,3-dimethyl-7H-[1]benzofuro[2,3-c]pyridin-7-id-6-yl)-3-pyridinyl]-trimethylsilane;dimethyl-[6-(7-methyl-3H-dibenzofuran-3-id-2-yl)-3-pyridinyl]-phenylsilane;tris(4-hydroxypent-3-en-2-one);tris(iridium)?
The InChIKey is SJDAWPCRPIOPBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H22NOSi.C21H21N2OSi.C20H18NOSi.3C5H8O2.3Ir/c1-18-9-12-22-23-16-19(10-14-25(23)28-26(22)15-18)24-13-11-21(17-27-24)29(2,3)20-7-5-4-6-8-20;1-13-10-18-17-11-15(6-9-20(17)24-21(18)14(2)23-13)19-8-7-16(12-22-19)25(3,4)5;1-23(2,3)15-9-10-18(21-13-15)14-8-11-20-17(12-14)16-6-4-5-7-19(16)22-20;3*1-4(6)3-5(2)7;;;/h4-9,11-17H,1-3H3;7-12H,1-5H3;4-7,9-13H,1-3H3;3*3,6H,1-2H3;;;/q3*-1;;;;;;.
What are the key properties of [6-(3H-dibenzofuran-3-id-2-yl)-3-pyridinyl]-trimethylsilane;[6-(1,3-dimethyl-7H-[1]benzofuro[2,3-c]pyridin-7-id-6-yl)-3-pyridinyl]-trimethylsilane;dimethyl-[6-(7-methyl-3H-dibenzofuran-3-id-2-yl)-3-pyridinyl]-phenylsilane;tris(4-hydroxypent-3-en-2-one);tris(iridium)?
[6-(3H-dibenzofuran-3-id-2-yl)-3-pyridinyl]-trimethylsilane;[6-(1,3-dimethyl-7H-[1]benzofuro[2,3-c]pyridin-7-id-6-yl)-3-pyridinyl]-trimethylsilane;dimethyl-[6-(7-methyl-3H-dibenzofuran-3-id-2-yl)-3-pyridinyl]-phenylsilane;tris(4-hydroxypent-3-en-2-one);tris(iridium) has a molecular weight of 1931.51 g/mol, XLogP of 18.68, 10 rotatable bonds, 3 hydrogen bond donors, and 13 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(3H-dibenzofuran-3-id-2-yl)-3-pyridinyl]-trimethylsilane;[6-(1,3-dimethyl-7H-[1]benzofuro[2,3-c]pyridin-7-id-6-yl)-3-pyridinyl]-trimethylsilane;dimethyl-[6-(7-methyl-3H-dibenzofuran-3-id-2-yl)-3-pyridinyl]-phenylsilane;tris(4-hydroxypent-3-en-2-one);tris(iridium) is sourced from PubChem (CID 158963238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).