trimethyl-[2-[6-[6-(2-trimethylsilylethynyl)-2-pyridinyl]-2-pyridinyl]ethynyl]silane

C40H48N4Si4 — CID 139154549

IUPACtrimethyl-[2-[6-[6-(2-trimethylsilylethynyl)-2-pyridinyl]-2-pyridinyl]ethynyl]silane
SMILESC[Si](C)(C)C#Cc1cccc(-c2cccc(C#C[Si](C)(C)C)n2)n1.C[Si](C)(C)C#Cc1cccc(-c2cccc(C#C[Si](C)(C)C)n2)n1
InChIInChI=1S/2C20H24N2Si2/c2*1-23(2,3)15-13-17-9-7-11-19(21-17)20-12-8-10-18(22-20)14-16-24(4,5)6/h2*7-12H,1-6H3
InChIKeyLLEZIFKYNDRVNI-UHFFFAOYSA-N
MW697.20 g/mol
LogP9.20
Rot. Bonds2

About trimethyl-[2-[6-[6-(2-trimethylsilylethynyl)-2-pyridinyl]-2-pyridinyl]ethynyl]silane

trimethyl-[2-[6-[6-(2-trimethylsilylethynyl)-2-pyridinyl]-2-pyridinyl]ethynyl]silane (PubChem CID 139154549) has the molecular formula C40H48N4Si4 and a molecular weight of 697.20 g/mol. Its IUPAC name is trimethyl-[2-[6-[6-(2-trimethylsilylethynyl)-2-pyridinyl]-2-pyridinyl]ethynyl]silane.

Molecular Properties

Compound Nametrimethyl-[2-[6-[6-(2-trimethylsilylethynyl)-2-pyridinyl]-2-pyridinyl]ethynyl]silane
PubChem CID139154549
Molecular FormulaC40H48N4Si4
Molecular Weight697.20 g/mol
Exact Mass696.30
IUPAC Nametrimethyl-[2-[6-[6-(2-trimethylsilylethynyl)-2-pyridinyl]-2-pyridinyl]ethynyl]silane
SMILESC[Si](C)(C)C#Cc1cccc(-c2cccc(C#C[Si](C)(C)C)n2)n1.C[Si](C)(C)C#Cc1cccc(-c2cccc(C#C[Si](C)(C)C)n2)n1
InChIInChI=1S/2C20H24N2Si2/c2*1-23(2,3)15-13-17-9-7-11-19(21-17)20-12-8-10-18(22-20)14-16-24(4,5)6/h2*7-12H,1-6H3
InChIKeyLLEZIFKYNDRVNI-UHFFFAOYSA-N
XLogP9.20
TPSA51.56 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms48
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500697.20
LogP ≤ 59.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze trimethyl-[2-[6-[6-(2-trimethylsilylethynyl)-2-pyridinyl]-2-pyridinyl]ethynyl]silane 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

6,6''-Dimethyl-2,2':6',2''-terpyridine
CID 11257813
Sexipyridine
CID 13062899
2,2'-Bipyridine, 6,6'-bis[(trimethylsilyl)ethynyl]-
CID 10760181
Trimethyl-[2-[6-[4-phenyl-6-[6-(2-trimethylsilylethynyl)-2-pyridinyl]-2-pyridinyl]-2-pyridinyl]ethynyl]silane
CID 10839157
2-Methyl-6-[6-(trifluoromethyl)-2-pyridinyl]pyridine;2-(trifluoromethyl)-6-[6-(trifluoromethyl)-2-pyridinyl]pyridine
CID 177002668
2-Methyl-6-[6-[[6-(6-methyl-2-pyridinyl)-2-pyridinyl]-phenylphosphoryl]-2-pyridinyl]pyridine
CID 11641219
2-Pyridin-2-yl-6-[2-(6-pyridin-2-yl-2-pyridinyl)ethynyl]pyridine
CID 91497163
2-(Piperidin-1-ylmethyl)-6-[2-[6-(piperidin-1-ylmethyl)-2-pyridinyl]ethyl]pyridine
CID 91527105
Trimethyl-[2-[6-[6-[6-(2-trimethylsilylethynyl)-2-pyridinyl]-2-pyridinyl]-2-pyridinyl]ethynyl]silane
CID 101170977
2,6-Bis[2-[6-[2-(triisopropylsilyl)ethynyl]-2-pyridyl]ethynyl]pyridine
CID 129693907
2-[2-[3,5-Bis[2-[6-(6-methyl-2-pyridinyl)-2-pyridinyl]ethynyl]phenyl]ethynyl]-6-(6-methyl-2-pyridinyl)pyridine
CID 134957820
Trimethyl-[2-[6-[4-phenyl-6-[6-(2-trimethylsilylethynyl)-2-pyridinyl]-2-pyridinyl]-2-pyridinyl]ethynyl]silane
CID 139154550

Frequently Asked Questions

What is the IUPAC name of trimethyl-[2-[6-[6-(2-trimethylsilylethynyl)-2-pyridinyl]-2-pyridinyl]ethynyl]silane?
The IUPAC name of trimethyl-[2-[6-[6-(2-trimethylsilylethynyl)-2-pyridinyl]-2-pyridinyl]ethynyl]silane (CID 139154549) is trimethyl-[2-[6-[6-(2-trimethylsilylethynyl)-2-pyridinyl]-2-pyridinyl]ethynyl]silane.
What is the SMILES notation for trimethyl-[2-[6-[6-(2-trimethylsilylethynyl)-2-pyridinyl]-2-pyridinyl]ethynyl]silane?
The canonical SMILES for trimethyl-[2-[6-[6-(2-trimethylsilylethynyl)-2-pyridinyl]-2-pyridinyl]ethynyl]silane is C[Si](C)(C)C#Cc1cccc(-c2cccc(C#C[Si](C)(C)C)n2)n1.C[Si](C)(C)C#Cc1cccc(-c2cccc(C#C[Si](C)(C)C)n2)n1.
What is the InChIKey of trimethyl-[2-[6-[6-(2-trimethylsilylethynyl)-2-pyridinyl]-2-pyridinyl]ethynyl]silane?
The InChIKey is LLEZIFKYNDRVNI-UHFFFAOYSA-N. The full InChI is InChI=1S/2C20H24N2Si2/c2*1-23(2,3)15-13-17-9-7-11-19(21-17)20-12-8-10-18(22-20)14-16-24(4,5)6/h2*7-12H,1-6H3.
What are the key properties of trimethyl-[2-[6-[6-(2-trimethylsilylethynyl)-2-pyridinyl]-2-pyridinyl]ethynyl]silane?
trimethyl-[2-[6-[6-(2-trimethylsilylethynyl)-2-pyridinyl]-2-pyridinyl]ethynyl]silane has a molecular weight of 697.20 g/mol, XLogP of 9.20, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[2-[6-[6-(2-trimethylsilylethynyl)-2-pyridinyl]-2-pyridinyl]ethynyl]silane is sourced from PubChem (CID 139154549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).