2-methyl-5-(2-trimethylsilylethoxymethyl)pyrrolidin-3-one

C11H23NO2Si — CID 175163668

IUPAC2-methyl-5-(2-trimethylsilylethoxymethyl)pyrrolidin-3-one
SMILESCC1NC(COCC[Si](C)(C)C)CC1=O
InChIInChI=1S/C11H23NO2Si/c1-9-11(13)7-10(12-9)8-14-5-6-15(2,3)4/h9-10,12H,5-8H2,1-4H3
InChIKeyJECHCGMPDSTRPZ-UHFFFAOYSA-N
MW229.40 g/mol
LogP1.66
Rot. Bonds5

About 2-methyl-5-(2-trimethylsilylethoxymethyl)pyrrolidin-3-one

2-methyl-5-(2-trimethylsilylethoxymethyl)pyrrolidin-3-one (PubChem CID 175163668) has the molecular formula C11H23NO2Si and a molecular weight of 229.40 g/mol. Its IUPAC name is 2-methyl-5-(2-trimethylsilylethoxymethyl)pyrrolidin-3-one.

Molecular Properties

Compound Name2-methyl-5-(2-trimethylsilylethoxymethyl)pyrrolidin-3-one
PubChem CID175163668
Molecular FormulaC11H23NO2Si
Molecular Weight229.40 g/mol
Exact Mass229.15
IUPAC Name2-methyl-5-(2-trimethylsilylethoxymethyl)pyrrolidin-3-one
SMILESCC1NC(COCC[Si](C)(C)C)CC1=O
InChIInChI=1S/C11H23NO2Si/c1-9-11(13)7-10(12-9)8-14-5-6-15(2,3)4/h9-10,12H,5-8H2,1-4H3
InChIKeyJECHCGMPDSTRPZ-UHFFFAOYSA-N
XLogP1.66
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.40
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-(2-trimethylsilylethoxymethyl)pyrrolidin-3-one?
The IUPAC name of 2-methyl-5-(2-trimethylsilylethoxymethyl)pyrrolidin-3-one (CID 175163668) is 2-methyl-5-(2-trimethylsilylethoxymethyl)pyrrolidin-3-one.
What is the SMILES notation for 2-methyl-5-(2-trimethylsilylethoxymethyl)pyrrolidin-3-one?
The canonical SMILES for 2-methyl-5-(2-trimethylsilylethoxymethyl)pyrrolidin-3-one is CC1NC(COCC[Si](C)(C)C)CC1=O.
What is the InChIKey of 2-methyl-5-(2-trimethylsilylethoxymethyl)pyrrolidin-3-one?
The InChIKey is JECHCGMPDSTRPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO2Si/c1-9-11(13)7-10(12-9)8-14-5-6-15(2,3)4/h9-10,12H,5-8H2,1-4H3.
What are the key properties of 2-methyl-5-(2-trimethylsilylethoxymethyl)pyrrolidin-3-one?
2-methyl-5-(2-trimethylsilylethoxymethyl)pyrrolidin-3-one has a molecular weight of 229.40 g/mol, XLogP of 1.66, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-(2-trimethylsilylethoxymethyl)pyrrolidin-3-one is sourced from PubChem (CID 175163668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).