trimethyl-[6-[7-(3-phenylpentan-3-yl)dibenzofuran-2-yl]-3-pyridinyl]silane

C31H33NOSi — CID 162709398

IUPACtrimethyl-[6-[7-(3-phenylpentan-3-yl)dibenzofuran-2-yl]-3-pyridinyl]silane
SMILESCCC(CC)(c1ccccc1)c1ccc2c(c1)oc1ccc(-c3ccc([Si](C)(C)C)cn3)cc12
InChIInChI=1S/C31H33NOSi/c1-6-31(7-2,23-11-9-8-10-12-23)24-14-16-26-27-19-22(13-18-29(27)33-30(26)20-24)28-17-15-25(21-32-28)34(3,4)5/h8-21H,6-7H2,1-5H3
InChIKeyNIPSVZYJJWYUEY-UHFFFAOYSA-N
MW463.70 g/mol
LogP8.30
Rot. Bonds6

About trimethyl-[6-[7-(3-phenylpentan-3-yl)dibenzofuran-2-yl]-3-pyridinyl]silane

trimethyl-[6-[7-(3-phenylpentan-3-yl)dibenzofuran-2-yl]-3-pyridinyl]silane (PubChem CID 162709398) has the molecular formula C31H33NOSi and a molecular weight of 463.70 g/mol. Its IUPAC name is trimethyl-[6-[7-(3-phenylpentan-3-yl)dibenzofuran-2-yl]-3-pyridinyl]silane.

Molecular Properties

Compound Nametrimethyl-[6-[7-(3-phenylpentan-3-yl)dibenzofuran-2-yl]-3-pyridinyl]silane
PubChem CID162709398
Molecular FormulaC31H33NOSi
Molecular Weight463.70 g/mol
Exact Mass463.23
IUPAC Nametrimethyl-[6-[7-(3-phenylpentan-3-yl)dibenzofuran-2-yl]-3-pyridinyl]silane
SMILESCCC(CC)(c1ccccc1)c1ccc2c(c1)oc1ccc(-c3ccc([Si](C)(C)C)cn3)cc12
InChIInChI=1S/C31H33NOSi/c1-6-31(7-2,23-11-9-8-10-12-23)24-14-16-26-27-19-22(13-18-29(27)33-30(26)20-24)28-17-15-25(21-32-28)34(3,4)5/h8-21H,6-7H2,1-5H3
InChIKeyNIPSVZYJJWYUEY-UHFFFAOYSA-N
XLogP8.30
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500463.70
LogP ≤ 58.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

trimethyl-[6-(3-methyl-[1]benzofuro[3,2-c]pyridin-8-yl)-3-pyridinyl]silane
CID 170532051
(6-dibenzofuran-2-yl-3-pyridinyl)-methyl-diphenylsilane
CID 140719613
trimethyl-(6-phenanthren-2-yl-3-pyridinyl)silane
CID 164792219
[6-(1,3-dimethyl-[1]benzofuro[3,2-c]pyridin-8-yl)-3-pyridinyl]-trimethylsilane
CID 140720101
4-tert-butyl-2-(7-phenyldibenzofuran-2-yl)pyridine
CID 155610550
dimethyl-[6-(2-methyl-[1]benzofuro[2,3-b]pyridin-6-yl)-3-pyridinyl]-phenylsilane
CID 140720059
[4-[3-(6-dibenzofuran-2-yl-3-pyridinyl)quinolin-7-yl]phenyl]-trimethylsilane
CID 169293694
trimethyl-[6-(7-naphthalen-1-yltriphenylen-2-yl)-3-pyridinyl]silane
CID 140721451
[6-(9-ethylcarbazol-3-yl)-3-pyridinyl]-trimethylsilane
CID 140719536
4-tert-butyl-2-[7-(2-phenylpropan-2-yl)-3H-dibenzofuran-3-id-2-yl]pyridine;iridium;trimethyl-(6-phenyl-3-pyridinyl)silane
CID 162710292
trimethyl-[6-(7-naphthalen-2-yltriphenylen-2-yl)-3-pyridinyl]silane
CID 140721404
5-[2-[3,5-bis[2-methyl-2-(6-phenyl-3-pyridinyl)propyl]phenyl]-1,1,2,2-tetradeuterioethyl]-2-dibenzofuran-3-ylpyridine
CID 171404793

Frequently Asked Questions

What is the IUPAC name of trimethyl-[6-[7-(3-phenylpentan-3-yl)dibenzofuran-2-yl]-3-pyridinyl]silane?
The IUPAC name of trimethyl-[6-[7-(3-phenylpentan-3-yl)dibenzofuran-2-yl]-3-pyridinyl]silane (CID 162709398) is trimethyl-[6-[7-(3-phenylpentan-3-yl)dibenzofuran-2-yl]-3-pyridinyl]silane.
What is the SMILES notation for trimethyl-[6-[7-(3-phenylpentan-3-yl)dibenzofuran-2-yl]-3-pyridinyl]silane?
The canonical SMILES for trimethyl-[6-[7-(3-phenylpentan-3-yl)dibenzofuran-2-yl]-3-pyridinyl]silane is CCC(CC)(c1ccccc1)c1ccc2c(c1)oc1ccc(-c3ccc([Si](C)(C)C)cn3)cc12.
What is the InChIKey of trimethyl-[6-[7-(3-phenylpentan-3-yl)dibenzofuran-2-yl]-3-pyridinyl]silane?
The InChIKey is NIPSVZYJJWYUEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H33NOSi/c1-6-31(7-2,23-11-9-8-10-12-23)24-14-16-26-27-19-22(13-18-29(27)33-30(26)20-24)28-17-15-25(21-32-28)34(3,4)5/h8-21H,6-7H2,1-5H3.
What are the key properties of trimethyl-[6-[7-(3-phenylpentan-3-yl)dibenzofuran-2-yl]-3-pyridinyl]silane?
trimethyl-[6-[7-(3-phenylpentan-3-yl)dibenzofuran-2-yl]-3-pyridinyl]silane has a molecular weight of 463.70 g/mol, XLogP of 8.30, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[6-[7-(3-phenylpentan-3-yl)dibenzofuran-2-yl]-3-pyridinyl]silane is sourced from PubChem (CID 162709398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).