2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]-N-(3-triethoxysilylpropyl)acetamide

C20H43NO9Si — CID 71617959

IUPAC2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]-N-(3-triethoxysilylpropyl)acetamide
SMILESCCO[Si](CCCNC(=O)COCCOCCOCCOCCOC)(OCC)OCC
InChIInChI=1S/C20H43NO9Si/c1-5-28-31(29-6-2,30-7-3)18-8-9-21-20(22)19-27-17-16-26-15-14-25-13-12-24-11-10-23-4/h5-19H2,1-4H3,(H,21,22)
InChIKeyCKNQBVWVTGFJPI-UHFFFAOYSA-N
MW469.65 g/mol
LogP1.25
Rot. Bonds24

About 2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]-N-(3-triethoxysilylpropyl)acetamide

2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]-N-(3-triethoxysilylpropyl)acetamide (PubChem CID 71617959) has the molecular formula C20H43NO9Si and a molecular weight of 469.65 g/mol. Its IUPAC name is 2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]-N-(3-triethoxysilylpropyl)acetamide.

Molecular Properties

Compound Name2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]-N-(3-triethoxysilylpropyl)acetamide
PubChem CID71617959
Molecular FormulaC20H43NO9Si
Molecular Weight469.65 g/mol
Exact Mass469.27
IUPAC Name2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]-N-(3-triethoxysilylpropyl)acetamide
SMILESCCO[Si](CCCNC(=O)COCCOCCOCCOCCOC)(OCC)OCC
InChIInChI=1S/C20H43NO9Si/c1-5-28-31(29-6-2,30-7-3)18-8-9-21-20(22)19-27-17-16-26-15-14-25-13-12-24-11-10-23-4/h5-19H2,1-4H3,(H,21,22)
InChIKeyCKNQBVWVTGFJPI-UHFFFAOYSA-N
XLogP1.25
TPSA102.94 Ų
H-Bond Donors1
H-Bond Acceptors9
Rotatable Bonds24
Heavy Atoms31
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500469.65
LogP ≤ 51.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 109

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-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]-N-(3-triethoxysilylpropyl)acetamide?
The IUPAC name of 2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]-N-(3-triethoxysilylpropyl)acetamide (CID 71617959) is 2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]-N-(3-triethoxysilylpropyl)acetamide.
What is the SMILES notation for 2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]-N-(3-triethoxysilylpropyl)acetamide?
The canonical SMILES for 2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]-N-(3-triethoxysilylpropyl)acetamide is CCO[Si](CCCNC(=O)COCCOCCOCCOCCOC)(OCC)OCC.
What is the InChIKey of 2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]-N-(3-triethoxysilylpropyl)acetamide?
The InChIKey is CKNQBVWVTGFJPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H43NO9Si/c1-5-28-31(29-6-2,30-7-3)18-8-9-21-20(22)19-27-17-16-26-15-14-25-13-12-24-11-10-23-4/h5-19H2,1-4H3,(H,21,22).
What are the key properties of 2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]-N-(3-triethoxysilylpropyl)acetamide?
2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]-N-(3-triethoxysilylpropyl)acetamide has a molecular weight of 469.65 g/mol, XLogP of 1.25, 24 rotatable bonds, 1 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]-N-(3-triethoxysilylpropyl)acetamide is sourced from PubChem (CID 71617959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).