N-methyl-2-trimethoxysilylaniline

C10H17NO3Si — CID 54452313

IUPACN-methyl-2-trimethoxysilylaniline
SMILESCNc1ccccc1[Si](OC)(OC)OC
InChIInChI=1S/C10H17NO3Si/c1-11-9-7-5-6-8-10(9)15(12-2,13-3)14-4/h5-8,11H,1-4H3
InChIKeyGLUMEVJLWKKHLA-UHFFFAOYSA-N
MW227.34 g/mol
LogP0.81
Rot. Bonds5

About N-methyl-2-trimethoxysilylaniline

N-methyl-2-trimethoxysilylaniline (PubChem CID 54452313) has the molecular formula C10H17NO3Si and a molecular weight of 227.34 g/mol. Its IUPAC name is N-methyl-2-trimethoxysilylaniline.

Molecular Properties

Compound NameN-methyl-2-trimethoxysilylaniline
PubChem CID54452313
Molecular FormulaC10H17NO3Si
Molecular Weight227.34 g/mol
Exact Mass227.10
IUPAC NameN-methyl-2-trimethoxysilylaniline
SMILESCNc1ccccc1[Si](OC)(OC)OC
InChIInChI=1S/C10H17NO3Si/c1-11-9-7-5-6-8-10(9)15(12-2,13-3)14-4/h5-8,11H,1-4H3
InChIKeyGLUMEVJLWKKHLA-UHFFFAOYSA-N
XLogP0.81
TPSA39.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.34
LogP ≤ 50.81
H-Bond Donors ≤ 51
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-2-trimethoxysilylaniline?
The IUPAC name of N-methyl-2-trimethoxysilylaniline (CID 54452313) is N-methyl-2-trimethoxysilylaniline.
What is the SMILES notation for N-methyl-2-trimethoxysilylaniline?
The canonical SMILES for N-methyl-2-trimethoxysilylaniline is CNc1ccccc1[Si](OC)(OC)OC.
What is the InChIKey of N-methyl-2-trimethoxysilylaniline?
The InChIKey is GLUMEVJLWKKHLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO3Si/c1-11-9-7-5-6-8-10(9)15(12-2,13-3)14-4/h5-8,11H,1-4H3.
What are the key properties of N-methyl-2-trimethoxysilylaniline?
N-methyl-2-trimethoxysilylaniline has a molecular weight of 227.34 g/mol, XLogP of 0.81, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-trimethoxysilylaniline is sourced from PubChem (CID 54452313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).