2-(1-ethyl-2-methylimidazo[4,5-b]pyridin-5-yl)ethynyl-trimethylsilane

C14H19N3Si — CID 162380618

IUPAC2-(1-ethyl-2-methylimidazo[4,5-b]pyridin-5-yl)ethynyl-trimethylsilane
SMILESCCn1c(C)nc2nc(C#C[Si](C)(C)C)ccc21
InChIInChI=1S/C14H19N3Si/c1-6-17-11(2)15-14-13(17)8-7-12(16-14)9-10-18(3,4)5/h7-8H,6H2,1-5H3
InChIKeyYVDJOLZDYKUYRP-UHFFFAOYSA-N
MW257.41 g/mol
LogP2.99
Rot. Bonds1

About 2-(1-ethyl-2-methylimidazo[4,5-b]pyridin-5-yl)ethynyl-trimethylsilane

2-(1-ethyl-2-methylimidazo[4,5-b]pyridin-5-yl)ethynyl-trimethylsilane (PubChem CID 162380618) has the molecular formula C14H19N3Si and a molecular weight of 257.41 g/mol. Its IUPAC name is 2-(1-ethyl-2-methylimidazo[4,5-b]pyridin-5-yl)ethynyl-trimethylsilane.

Molecular Properties

Compound Name2-(1-ethyl-2-methylimidazo[4,5-b]pyridin-5-yl)ethynyl-trimethylsilane
PubChem CID162380618
Molecular FormulaC14H19N3Si
Molecular Weight257.41 g/mol
Exact Mass257.13
IUPAC Name2-(1-ethyl-2-methylimidazo[4,5-b]pyridin-5-yl)ethynyl-trimethylsilane
SMILESCCn1c(C)nc2nc(C#C[Si](C)(C)C)ccc21
InChIInChI=1S/C14H19N3Si/c1-6-17-11(2)15-14-13(17)8-7-12(16-14)9-10-18(3,4)5/h7-8H,6H2,1-5H3
InChIKeyYVDJOLZDYKUYRP-UHFFFAOYSA-N
XLogP2.99
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.41
LogP ≤ 52.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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-(1-ethyl-2-methylimidazo[4,5-b]pyridin-5-yl)ethynyl-trimethylsilane?
The IUPAC name of 2-(1-ethyl-2-methylimidazo[4,5-b]pyridin-5-yl)ethynyl-trimethylsilane (CID 162380618) is 2-(1-ethyl-2-methylimidazo[4,5-b]pyridin-5-yl)ethynyl-trimethylsilane.
What is the SMILES notation for 2-(1-ethyl-2-methylimidazo[4,5-b]pyridin-5-yl)ethynyl-trimethylsilane?
The canonical SMILES for 2-(1-ethyl-2-methylimidazo[4,5-b]pyridin-5-yl)ethynyl-trimethylsilane is CCn1c(C)nc2nc(C#C[Si](C)(C)C)ccc21.
What is the InChIKey of 2-(1-ethyl-2-methylimidazo[4,5-b]pyridin-5-yl)ethynyl-trimethylsilane?
The InChIKey is YVDJOLZDYKUYRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3Si/c1-6-17-11(2)15-14-13(17)8-7-12(16-14)9-10-18(3,4)5/h7-8H,6H2,1-5H3.
What are the key properties of 2-(1-ethyl-2-methylimidazo[4,5-b]pyridin-5-yl)ethynyl-trimethylsilane?
2-(1-ethyl-2-methylimidazo[4,5-b]pyridin-5-yl)ethynyl-trimethylsilane has a molecular weight of 257.41 g/mol, XLogP of 2.99, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-ethyl-2-methylimidazo[4,5-b]pyridin-5-yl)ethynyl-trimethylsilane is sourced from PubChem (CID 162380618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).