2-(6-ethyl-2-pyridinyl)ethynyl-trimethylsilane

C12H17NSi — CID 140713694

IUPAC2-(6-ethyl-2-pyridinyl)ethynyl-trimethylsilane
SMILESCCc1cccc(C#C[Si](C)(C)C)n1
InChIInChI=1S/C12H17NSi/c1-5-11-7-6-8-12(13-11)9-10-14(2,3)4/h6-8H,5H2,1-4H3
InChIKeyWSDYPPJYTYHTAA-UHFFFAOYSA-N
MW203.36 g/mol
LogP2.87
Rot. Bonds1

About 2-(6-ethyl-2-pyridinyl)ethynyl-trimethylsilane

2-(6-ethyl-2-pyridinyl)ethynyl-trimethylsilane (PubChem CID 140713694) has the molecular formula C12H17NSi and a molecular weight of 203.36 g/mol. Its IUPAC name is 2-(6-ethyl-2-pyridinyl)ethynyl-trimethylsilane.

Molecular Properties

Compound Name2-(6-ethyl-2-pyridinyl)ethynyl-trimethylsilane
PubChem CID140713694
Molecular FormulaC12H17NSi
Molecular Weight203.36 g/mol
Exact Mass203.11
IUPAC Name2-(6-ethyl-2-pyridinyl)ethynyl-trimethylsilane
SMILESCCc1cccc(C#C[Si](C)(C)C)n1
InChIInChI=1S/C12H17NSi/c1-5-11-7-6-8-12(13-11)9-10-14(2,3)4/h6-8H,5H2,1-4H3
InChIKeyWSDYPPJYTYHTAA-UHFFFAOYSA-N
XLogP2.87
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.36
LogP ≤ 52.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(6-ethyl-2-pyridinyl)ethynyl-trimethylsilane?
The IUPAC name of 2-(6-ethyl-2-pyridinyl)ethynyl-trimethylsilane (CID 140713694) is 2-(6-ethyl-2-pyridinyl)ethynyl-trimethylsilane.
What is the SMILES notation for 2-(6-ethyl-2-pyridinyl)ethynyl-trimethylsilane?
The canonical SMILES for 2-(6-ethyl-2-pyridinyl)ethynyl-trimethylsilane is CCc1cccc(C#C[Si](C)(C)C)n1.
What is the InChIKey of 2-(6-ethyl-2-pyridinyl)ethynyl-trimethylsilane?
The InChIKey is WSDYPPJYTYHTAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NSi/c1-5-11-7-6-8-12(13-11)9-10-14(2,3)4/h6-8H,5H2,1-4H3.
What are the key properties of 2-(6-ethyl-2-pyridinyl)ethynyl-trimethylsilane?
2-(6-ethyl-2-pyridinyl)ethynyl-trimethylsilane has a molecular weight of 203.36 g/mol, XLogP of 2.87, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-ethyl-2-pyridinyl)ethynyl-trimethylsilane is sourced from PubChem (CID 140713694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).