N-methyl-N-(2-triethoxysilylpropyl)acetamide

C12H27NO4Si — CID 54084477

IUPACN-methyl-N-(2-triethoxysilylpropyl)acetamide
SMILESCCO[Si](OCC)(OCC)C(C)CN(C)C(C)=O
InChIInChI=1S/C12H27NO4Si/c1-7-15-18(16-8-2,17-9-3)11(4)10-13(6)12(5)14/h11H,7-10H2,1-6H3
InChIKeyMPLHBIISAXDVEN-UHFFFAOYSA-N
MW277.44 g/mol
LogP1.90
Rot. Bonds9

About N-methyl-N-(2-triethoxysilylpropyl)acetamide

N-methyl-N-(2-triethoxysilylpropyl)acetamide (PubChem CID 54084477) has the molecular formula C12H27NO4Si and a molecular weight of 277.44 g/mol. Its IUPAC name is N-methyl-N-(2-triethoxysilylpropyl)acetamide.

Molecular Properties

Compound NameN-methyl-N-(2-triethoxysilylpropyl)acetamide
PubChem CID54084477
Molecular FormulaC12H27NO4Si
Molecular Weight277.44 g/mol
Exact Mass277.17
IUPAC NameN-methyl-N-(2-triethoxysilylpropyl)acetamide
SMILESCCO[Si](OCC)(OCC)C(C)CN(C)C(C)=O
InChIInChI=1S/C12H27NO4Si/c1-7-15-18(16-8-2,17-9-3)11(4)10-13(6)12(5)14/h11H,7-10H2,1-6H3
InChIKeyMPLHBIISAXDVEN-UHFFFAOYSA-N
XLogP1.90
TPSA48.00 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.44
LogP ≤ 51.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(2-triethoxysilylpropyl)acetamide?
The IUPAC name of N-methyl-N-(2-triethoxysilylpropyl)acetamide (CID 54084477) is N-methyl-N-(2-triethoxysilylpropyl)acetamide.
What is the SMILES notation for N-methyl-N-(2-triethoxysilylpropyl)acetamide?
The canonical SMILES for N-methyl-N-(2-triethoxysilylpropyl)acetamide is CCO[Si](OCC)(OCC)C(C)CN(C)C(C)=O.
What is the InChIKey of N-methyl-N-(2-triethoxysilylpropyl)acetamide?
The InChIKey is MPLHBIISAXDVEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H27NO4Si/c1-7-15-18(16-8-2,17-9-3)11(4)10-13(6)12(5)14/h11H,7-10H2,1-6H3.
What are the key properties of N-methyl-N-(2-triethoxysilylpropyl)acetamide?
N-methyl-N-(2-triethoxysilylpropyl)acetamide has a molecular weight of 277.44 g/mol, XLogP of 1.90, 9 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(2-triethoxysilylpropyl)acetamide is sourced from PubChem (CID 54084477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).