trimethyl(2-thieno[2,3-b]pyridin-2-ylethynyl)silane

C12H13NSSi — CID 69472098

IUPACtrimethyl(2-thieno[2,3-b]pyridin-2-ylethynyl)silane
SMILESC[Si](C)(C)C#Cc1cc2cccnc2s1
InChIInChI=1S/C12H13NSSi/c1-15(2,3)8-6-11-9-10-5-4-7-13-12(10)14-11/h4-5,7,9H,1-3H3
InChIKeyOMVMXMLKIZOVDR-UHFFFAOYSA-N
MW231.40 g/mol
LogP3.53
Rot. Bonds

About trimethyl(2-thieno[2,3-b]pyridin-2-ylethynyl)silane

trimethyl(2-thieno[2,3-b]pyridin-2-ylethynyl)silane (PubChem CID 69472098) has the molecular formula C12H13NSSi and a molecular weight of 231.40 g/mol. Its IUPAC name is trimethyl(2-thieno[2,3-b]pyridin-2-ylethynyl)silane.

Molecular Properties

Compound Nametrimethyl(2-thieno[2,3-b]pyridin-2-ylethynyl)silane
PubChem CID69472098
Molecular FormulaC12H13NSSi
Molecular Weight231.40 g/mol
Exact Mass231.05
IUPAC Nametrimethyl(2-thieno[2,3-b]pyridin-2-ylethynyl)silane
SMILESC[Si](C)(C)C#Cc1cc2cccnc2s1
InChIInChI=1S/C12H13NSSi/c1-15(2,3)8-6-11-9-10-5-4-7-13-12(10)14-11/h4-5,7,9H,1-3H3
InChIKeyOMVMXMLKIZOVDR-UHFFFAOYSA-N
XLogP3.53
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.40
LogP ≤ 53.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 trimethyl(2-thieno[2,3-b]pyridin-2-ylethynyl)silane?
The IUPAC name of trimethyl(2-thieno[2,3-b]pyridin-2-ylethynyl)silane (CID 69472098) is trimethyl(2-thieno[2,3-b]pyridin-2-ylethynyl)silane.
What is the SMILES notation for trimethyl(2-thieno[2,3-b]pyridin-2-ylethynyl)silane?
The canonical SMILES for trimethyl(2-thieno[2,3-b]pyridin-2-ylethynyl)silane is C[Si](C)(C)C#Cc1cc2cccnc2s1.
What is the InChIKey of trimethyl(2-thieno[2,3-b]pyridin-2-ylethynyl)silane?
The InChIKey is OMVMXMLKIZOVDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13NSSi/c1-15(2,3)8-6-11-9-10-5-4-7-13-12(10)14-11/h4-5,7,9H,1-3H3.
What are the key properties of trimethyl(2-thieno[2,3-b]pyridin-2-ylethynyl)silane?
trimethyl(2-thieno[2,3-b]pyridin-2-ylethynyl)silane has a molecular weight of 231.40 g/mol, XLogP of 3.53, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl(2-thieno[2,3-b]pyridin-2-ylethynyl)silane is sourced from PubChem (CID 69472098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).