methyl 2-methyl-2-[6-(2-trimethylsilylethoxy)-2-pyridinyl]propanoate

C15H25NO3Si — CID 177166836

IUPACmethyl 2-methyl-2-[6-(2-trimethylsilylethoxy)-2-pyridinyl]propanoate
SMILESCOC(=O)C(C)(C)c1cccc(OCC[Si](C)(C)C)n1
InChIInChI=1S/C15H25NO3Si/c1-15(2,14(17)18-3)12-8-7-9-13(16-12)19-10-11-20(4,5)6/h7-9H,10-11H2,1-6H3
InChIKeyAFGVRWJXTYEBES-UHFFFAOYSA-N
MW295.45 g/mol
LogP3.25
Rot. Bonds6

About methyl 2-methyl-2-[6-(2-trimethylsilylethoxy)-2-pyridinyl]propanoate

methyl 2-methyl-2-[6-(2-trimethylsilylethoxy)-2-pyridinyl]propanoate (PubChem CID 177166836) has the molecular formula C15H25NO3Si and a molecular weight of 295.45 g/mol. Its IUPAC name is methyl 2-methyl-2-[6-(2-trimethylsilylethoxy)-2-pyridinyl]propanoate.

Molecular Properties

Compound Namemethyl 2-methyl-2-[6-(2-trimethylsilylethoxy)-2-pyridinyl]propanoate
PubChem CID177166836
Molecular FormulaC15H25NO3Si
Molecular Weight295.45 g/mol
Exact Mass295.16
IUPAC Namemethyl 2-methyl-2-[6-(2-trimethylsilylethoxy)-2-pyridinyl]propanoate
SMILESCOC(=O)C(C)(C)c1cccc(OCC[Si](C)(C)C)n1
InChIInChI=1S/C15H25NO3Si/c1-15(2,14(17)18-3)12-8-7-9-13(16-12)19-10-11-20(4,5)6/h7-9H,10-11H2,1-6H3
InChIKeyAFGVRWJXTYEBES-UHFFFAOYSA-N
XLogP3.25
TPSA48.42 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.45
LogP ≤ 53.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Analyze methyl 2-methyl-2-[6-(2-trimethylsilylethoxy)-2-pyridinyl]propanoate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of methyl 2-methyl-2-[6-(2-trimethylsilylethoxy)-2-pyridinyl]propanoate?
The IUPAC name of methyl 2-methyl-2-[6-(2-trimethylsilylethoxy)-2-pyridinyl]propanoate (CID 177166836) is methyl 2-methyl-2-[6-(2-trimethylsilylethoxy)-2-pyridinyl]propanoate.
What is the SMILES notation for methyl 2-methyl-2-[6-(2-trimethylsilylethoxy)-2-pyridinyl]propanoate?
The canonical SMILES for methyl 2-methyl-2-[6-(2-trimethylsilylethoxy)-2-pyridinyl]propanoate is COC(=O)C(C)(C)c1cccc(OCC[Si](C)(C)C)n1.
What is the InChIKey of methyl 2-methyl-2-[6-(2-trimethylsilylethoxy)-2-pyridinyl]propanoate?
The InChIKey is AFGVRWJXTYEBES-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO3Si/c1-15(2,14(17)18-3)12-8-7-9-13(16-12)19-10-11-20(4,5)6/h7-9H,10-11H2,1-6H3.
What are the key properties of methyl 2-methyl-2-[6-(2-trimethylsilylethoxy)-2-pyridinyl]propanoate?
methyl 2-methyl-2-[6-(2-trimethylsilylethoxy)-2-pyridinyl]propanoate has a molecular weight of 295.45 g/mol, XLogP of 3.25, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-methyl-2-[6-(2-trimethylsilylethoxy)-2-pyridinyl]propanoate is sourced from PubChem (CID 177166836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).