6-(2-trimethylsilylethynyl)pyridine-2-carbonitrile

C11H12N2Si — CID 135049966

IUPAC6-(2-trimethylsilylethynyl)pyridine-2-carbonitrile
SMILESC[Si](C)(C)C#Cc1cccc(C#N)n1
InChIInChI=1S/C11H12N2Si/c1-14(2,3)8-7-10-5-4-6-11(9-12)13-10/h4-6H,1-3H3
InChIKeyKUFYEWRIBSIFIZ-UHFFFAOYSA-N
MW200.32 g/mol
LogP2.18
Rot. Bonds

About 6-(2-trimethylsilylethynyl)pyridine-2-carbonitrile

6-(2-trimethylsilylethynyl)pyridine-2-carbonitrile (PubChem CID 135049966) has the molecular formula C11H12N2Si and a molecular weight of 200.32 g/mol. Its IUPAC name is 6-(2-trimethylsilylethynyl)pyridine-2-carbonitrile.

Molecular Properties

Compound Name6-(2-trimethylsilylethynyl)pyridine-2-carbonitrile
PubChem CID135049966
Molecular FormulaC11H12N2Si
Molecular Weight200.32 g/mol
Exact Mass200.08
IUPAC Name6-(2-trimethylsilylethynyl)pyridine-2-carbonitrile
SMILESC[Si](C)(C)C#Cc1cccc(C#N)n1
InChIInChI=1S/C11H12N2Si/c1-14(2,3)8-7-10-5-4-6-11(9-12)13-10/h4-6H,1-3H3
InChIKeyKUFYEWRIBSIFIZ-UHFFFAOYSA-N
XLogP2.18
TPSA36.68 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.32
LogP ≤ 52.18
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 6-(2-trimethylsilylethynyl)pyridine-2-carbonitrile?
The IUPAC name of 6-(2-trimethylsilylethynyl)pyridine-2-carbonitrile (CID 135049966) is 6-(2-trimethylsilylethynyl)pyridine-2-carbonitrile.
What is the SMILES notation for 6-(2-trimethylsilylethynyl)pyridine-2-carbonitrile?
The canonical SMILES for 6-(2-trimethylsilylethynyl)pyridine-2-carbonitrile is C[Si](C)(C)C#Cc1cccc(C#N)n1.
What is the InChIKey of 6-(2-trimethylsilylethynyl)pyridine-2-carbonitrile?
The InChIKey is KUFYEWRIBSIFIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2Si/c1-14(2,3)8-7-10-5-4-6-11(9-12)13-10/h4-6H,1-3H3.
What are the key properties of 6-(2-trimethylsilylethynyl)pyridine-2-carbonitrile?
6-(2-trimethylsilylethynyl)pyridine-2-carbonitrile has a molecular weight of 200.32 g/mol, XLogP of 2.18, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-trimethylsilylethynyl)pyridine-2-carbonitrile is sourced from PubChem (CID 135049966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).