trimethyl-[2-(2-pyridin-2-ylphenyl)ethynyl]silane

C16H17NSi — CID 11086229

IUPACtrimethyl-[2-(2-pyridin-2-ylphenyl)ethynyl]silane
SMILESC[Si](C)(C)C#Cc1ccccc1-c1ccccn1
InChIInChI=1S/C16H17NSi/c1-18(2,3)13-11-14-8-4-5-9-15(14)16-10-6-7-12-17-16/h4-10,12H,1-3H3
InChIKeyIPVDQXOENVSBPG-UHFFFAOYSA-N
MW251.41 g/mol
LogP3.98
Rot. Bonds1

About trimethyl-[2-(2-pyridin-2-ylphenyl)ethynyl]silane

trimethyl-[2-(2-pyridin-2-ylphenyl)ethynyl]silane (PubChem CID 11086229) has the molecular formula C16H17NSi and a molecular weight of 251.41 g/mol. Its IUPAC name is trimethyl-[2-(2-pyridin-2-ylphenyl)ethynyl]silane.

Molecular Properties

Compound Nametrimethyl-[2-(2-pyridin-2-ylphenyl)ethynyl]silane
PubChem CID11086229
Molecular FormulaC16H17NSi
Molecular Weight251.41 g/mol
Exact Mass251.11
IUPAC Nametrimethyl-[2-(2-pyridin-2-ylphenyl)ethynyl]silane
SMILESC[Si](C)(C)C#Cc1ccccc1-c1ccccn1
InChIInChI=1S/C16H17NSi/c1-18(2,3)13-11-14-8-4-5-9-15(14)16-10-6-7-12-17-16/h4-10,12H,1-3H3
InChIKeyIPVDQXOENVSBPG-UHFFFAOYSA-N
XLogP3.98
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.41
LogP ≤ 53.98
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 trimethyl-[2-(2-pyridin-2-ylphenyl)ethynyl]silane?
The IUPAC name of trimethyl-[2-(2-pyridin-2-ylphenyl)ethynyl]silane (CID 11086229) is trimethyl-[2-(2-pyridin-2-ylphenyl)ethynyl]silane.
What is the SMILES notation for trimethyl-[2-(2-pyridin-2-ylphenyl)ethynyl]silane?
The canonical SMILES for trimethyl-[2-(2-pyridin-2-ylphenyl)ethynyl]silane is C[Si](C)(C)C#Cc1ccccc1-c1ccccn1.
What is the InChIKey of trimethyl-[2-(2-pyridin-2-ylphenyl)ethynyl]silane?
The InChIKey is IPVDQXOENVSBPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17NSi/c1-18(2,3)13-11-14-8-4-5-9-15(14)16-10-6-7-12-17-16/h4-10,12H,1-3H3.
What are the key properties of trimethyl-[2-(2-pyridin-2-ylphenyl)ethynyl]silane?
trimethyl-[2-(2-pyridin-2-ylphenyl)ethynyl]silane has a molecular weight of 251.41 g/mol, XLogP of 3.98, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[2-(2-pyridin-2-ylphenyl)ethynyl]silane is sourced from PubChem (CID 11086229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).