triethyl-[4-[2-naphthalen-1-yl-6-[4-[4-[2-(4-trimethylsilylphenyl)phenyl]phenyl]phenyl]-4-pyridinyl]phenyl]silane

C54H53NSi2 — CID 176645612

IUPACtriethyl-[4-[2-naphthalen-1-yl-6-[4-[4-[2-(4-trimethylsilylphenyl)phenyl]phenyl]phenyl]-4-pyridinyl]phenyl]silane
SMILESCC[Si](CC)(CC)c1ccc(-c2cc(-c3ccc(-c4ccc(-c5ccccc5-c5ccc([Si](C)(C)C)cc5)cc4)cc3)nc(-c3cccc4ccccc34)c2)cc1
InChIInChI=1S/C54H53NSi2/c1-7-57(8-2,9-3)48-35-29-41(30-36-48)46-37-53(55-54(38-46)52-20-14-16-42-15-10-11-19-51(42)52)45-27-23-40(24-28-45)39-21-25-43(26-22-39)49-17-12-13-18-50(49)44-31-33-47(34-32-44)56(4,5)6/h10-38H,7-9H2,1-6H3
InChIKeyCCOYEWBUGCZVTI-UHFFFAOYSA-N
MW772.20 g/mol
LogP14.50
Rot. Bonds11

About triethyl-[4-[2-naphthalen-1-yl-6-[4-[4-[2-(4-trimethylsilylphenyl)phenyl]phenyl]phenyl]-4-pyridinyl]phenyl]silane

triethyl-[4-[2-naphthalen-1-yl-6-[4-[4-[2-(4-trimethylsilylphenyl)phenyl]phenyl]phenyl]-4-pyridinyl]phenyl]silane (PubChem CID 176645612) has the molecular formula C54H53NSi2 and a molecular weight of 772.20 g/mol. Its IUPAC name is triethyl-[4-[2-naphthalen-1-yl-6-[4-[4-[2-(4-trimethylsilylphenyl)phenyl]phenyl]phenyl]-4-pyridinyl]phenyl]silane.

Molecular Properties

Compound Nametriethyl-[4-[2-naphthalen-1-yl-6-[4-[4-[2-(4-trimethylsilylphenyl)phenyl]phenyl]phenyl]-4-pyridinyl]phenyl]silane
PubChem CID176645612
Molecular FormulaC54H53NSi2
Molecular Weight772.20 g/mol
Exact Mass771.37
IUPAC Nametriethyl-[4-[2-naphthalen-1-yl-6-[4-[4-[2-(4-trimethylsilylphenyl)phenyl]phenyl]phenyl]-4-pyridinyl]phenyl]silane
SMILESCC[Si](CC)(CC)c1ccc(-c2cc(-c3ccc(-c4ccc(-c5ccccc5-c5ccc([Si](C)(C)C)cc5)cc4)cc3)nc(-c3cccc4ccccc34)c2)cc1
InChIInChI=1S/C54H53NSi2/c1-7-57(8-2,9-3)48-35-29-41(30-36-48)46-37-53(55-54(38-46)52-20-14-16-42-15-10-11-19-51(42)52)45-27-23-40(24-28-45)39-21-25-43(26-22-39)49-17-12-13-18-50(49)44-31-33-47(34-32-44)56(4,5)6/h10-38H,7-9H2,1-6H3
InChIKeyCCOYEWBUGCZVTI-UHFFFAOYSA-N
XLogP14.50
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds11
Heavy Atoms57
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500772.20
LogP ≤ 514.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

[4-[6-[6-(4,6-diphenyl-2-pyridinyl)-2-pyridinyl]-2-pyridinyl]phenyl]-triethylsilane
CID 176645706
4-naphthalen-1-yl-6-(4-naphthalen-1-ylphenyl)-2-(4-phenylphenyl)pyrimidine
CID 159653771
[4-[4-[4-[3-[3-(4,6-diphenyl-2-pyridinyl)phenyl]phenyl]phenyl]phenyl]phenyl]-trimethylsilane
CID 176645644
2-[4-[2-(4-naphthalen-1-ylphenyl)propan-2-yl]phenyl]-4,6-diphenylpyridine
CID 121315369
trimethyl-[4-[4-[4-[3-(3-naphthalen-1-ylphenyl)phenyl]-6-[4-(4-trimethylsilylphenyl)phenyl]-1,3,5-triazin-2-yl]phenyl]phenyl]silane
CID 176645429
2,6-bis(3-naphthalen-1-ylphenyl)-4-[4-(3-naphthalen-1-ylphenyl)phenyl]pyridine
CID 118901430
2-naphthalen-1-yl-4,6-bis(4-naphthalen-1-ylphenyl)pyrimidine
CID 129265535
2-methyl-4-(4-naphthalen-1-ylphenyl)-6-(4-phenylphenyl)pyrimidine
CID 130260993
2-[4-[5-[4-(4,6-diphenyl-2-pyridinyl)phenyl]naphthalen-2-yl]phenyl]-4,6-diphenylpyridine
CID 118075155
4-(3,5-diphenylphenyl)-2-methyl-6-(4-naphthalen-1-ylphenyl)pyrimidine;2-methyl-4-(4-naphthalen-1-ylphenyl)-6-(3-phenylphenyl)pyrimidine;2-methyl-4-(4-naphthalen-1-ylphenyl)-6-(4-phenylphenyl)pyrimidine
CID 161366762
2-[4-[5-[4-(2,6-diphenyl-4-pyridinyl)phenyl]naphthalen-1-yl]phenyl]-4,6-diphenyl-1,3,5-triazine
CID 121402218
2,6-diphenyl-4-[4-(6-phenyldibenzofuran-4-yl)phenyl]pyridine
CID 171761157

Frequently Asked Questions

What is the IUPAC name of triethyl-[4-[2-naphthalen-1-yl-6-[4-[4-[2-(4-trimethylsilylphenyl)phenyl]phenyl]phenyl]-4-pyridinyl]phenyl]silane?
The IUPAC name of triethyl-[4-[2-naphthalen-1-yl-6-[4-[4-[2-(4-trimethylsilylphenyl)phenyl]phenyl]phenyl]-4-pyridinyl]phenyl]silane (CID 176645612) is triethyl-[4-[2-naphthalen-1-yl-6-[4-[4-[2-(4-trimethylsilylphenyl)phenyl]phenyl]phenyl]-4-pyridinyl]phenyl]silane.
What is the SMILES notation for triethyl-[4-[2-naphthalen-1-yl-6-[4-[4-[2-(4-trimethylsilylphenyl)phenyl]phenyl]phenyl]-4-pyridinyl]phenyl]silane?
The canonical SMILES for triethyl-[4-[2-naphthalen-1-yl-6-[4-[4-[2-(4-trimethylsilylphenyl)phenyl]phenyl]phenyl]-4-pyridinyl]phenyl]silane is CC[Si](CC)(CC)c1ccc(-c2cc(-c3ccc(-c4ccc(-c5ccccc5-c5ccc([Si](C)(C)C)cc5)cc4)cc3)nc(-c3cccc4ccccc34)c2)cc1.
What is the InChIKey of triethyl-[4-[2-naphthalen-1-yl-6-[4-[4-[2-(4-trimethylsilylphenyl)phenyl]phenyl]phenyl]-4-pyridinyl]phenyl]silane?
The InChIKey is CCOYEWBUGCZVTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C54H53NSi2/c1-7-57(8-2,9-3)48-35-29-41(30-36-48)46-37-53(55-54(38-46)52-20-14-16-42-15-10-11-19-51(42)52)45-27-23-40(24-28-45)39-21-25-43(26-22-39)49-17-12-13-18-50(49)44-31-33-47(34-32-44)56(4,5)6/h10-38H,7-9H2,1-6H3.
What are the key properties of triethyl-[4-[2-naphthalen-1-yl-6-[4-[4-[2-(4-trimethylsilylphenyl)phenyl]phenyl]phenyl]-4-pyridinyl]phenyl]silane?
triethyl-[4-[2-naphthalen-1-yl-6-[4-[4-[2-(4-trimethylsilylphenyl)phenyl]phenyl]phenyl]-4-pyridinyl]phenyl]silane has a molecular weight of 772.20 g/mol, XLogP of 14.50, 11 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for triethyl-[4-[2-naphthalen-1-yl-6-[4-[4-[2-(4-trimethylsilylphenyl)phenyl]phenyl]phenyl]-4-pyridinyl]phenyl]silane is sourced from PubChem (CID 176645612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).