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

C16H17NOSi — CID 21270306

IUPACtrimethyl-[2-(6-phenoxy-2-pyridinyl)ethynyl]silane
SMILESC[Si](C)(C)C#Cc1cccc(Oc2ccccc2)n1
InChIInChI=1S/C16H17NOSi/c1-19(2,3)13-12-14-8-7-11-16(17-14)18-15-9-5-4-6-10-15/h4-11H,1-3H3
InChIKeyKLOMCGFKXPDFQJ-UHFFFAOYSA-N
MW267.40 g/mol
LogP4.10
Rot. Bonds2

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

trimethyl-[2-(6-phenoxy-2-pyridinyl)ethynyl]silane (PubChem CID 21270306) has the molecular formula C16H17NOSi and a molecular weight of 267.40 g/mol. Its IUPAC name is trimethyl-[2-(6-phenoxy-2-pyridinyl)ethynyl]silane.

Molecular Properties

Compound Nametrimethyl-[2-(6-phenoxy-2-pyridinyl)ethynyl]silane
PubChem CID21270306
Molecular FormulaC16H17NOSi
Molecular Weight267.40 g/mol
Exact Mass267.11
IUPAC Nametrimethyl-[2-(6-phenoxy-2-pyridinyl)ethynyl]silane
SMILESC[Si](C)(C)C#Cc1cccc(Oc2ccccc2)n1
InChIInChI=1S/C16H17NOSi/c1-19(2,3)13-12-14-8-7-11-16(17-14)18-15-9-5-4-6-10-15/h4-11H,1-3H3
InChIKeyKLOMCGFKXPDFQJ-UHFFFAOYSA-N
XLogP4.10
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.40
LogP ≤ 54.10
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-(6-phenoxy-2-pyridinyl)ethynyl]silane?
The IUPAC name of trimethyl-[2-(6-phenoxy-2-pyridinyl)ethynyl]silane (CID 21270306) is trimethyl-[2-(6-phenoxy-2-pyridinyl)ethynyl]silane.
What is the SMILES notation for trimethyl-[2-(6-phenoxy-2-pyridinyl)ethynyl]silane?
The canonical SMILES for trimethyl-[2-(6-phenoxy-2-pyridinyl)ethynyl]silane is C[Si](C)(C)C#Cc1cccc(Oc2ccccc2)n1.
What is the InChIKey of trimethyl-[2-(6-phenoxy-2-pyridinyl)ethynyl]silane?
The InChIKey is KLOMCGFKXPDFQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17NOSi/c1-19(2,3)13-12-14-8-7-11-16(17-14)18-15-9-5-4-6-10-15/h4-11H,1-3H3.
What are the key properties of trimethyl-[2-(6-phenoxy-2-pyridinyl)ethynyl]silane?
trimethyl-[2-(6-phenoxy-2-pyridinyl)ethynyl]silane has a molecular weight of 267.40 g/mol, XLogP of 4.10, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[2-(6-phenoxy-2-pyridinyl)ethynyl]silane is sourced from PubChem (CID 21270306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).