2-(3-trimethoxysilylpropoxy)-N-[2-(3-trimethoxysilylpropoxy)ethyl]ethanamine

C16H39NO8Si2 — CID 141439951

IUPAC2-(3-trimethoxysilylpropoxy)-N-[2-(3-trimethoxysilylpropoxy)ethyl]ethanamine
SMILESCO[Si](CCCOCCNCCOCCC[Si](OC)(OC)OC)(OC)OC
InChIInChI=1S/C16H39NO8Si2/c1-18-26(19-2,20-3)15-7-11-24-13-9-17-10-14-25-12-8-16-27(21-4,22-5)23-6/h17H,7-16H2,1-6H3
InChIKeyVZDYTMKBKRNAJM-UHFFFAOYSA-N
MW429.66 g/mol
LogP1.15
Rot. Bonds20

About 2-(3-trimethoxysilylpropoxy)-N-[2-(3-trimethoxysilylpropoxy)ethyl]ethanamine

2-(3-trimethoxysilylpropoxy)-N-[2-(3-trimethoxysilylpropoxy)ethyl]ethanamine (PubChem CID 141439951) has the molecular formula C16H39NO8Si2 and a molecular weight of 429.66 g/mol. Its IUPAC name is 2-(3-trimethoxysilylpropoxy)-N-[2-(3-trimethoxysilylpropoxy)ethyl]ethanamine.

Molecular Properties

Compound Name2-(3-trimethoxysilylpropoxy)-N-[2-(3-trimethoxysilylpropoxy)ethyl]ethanamine
PubChem CID141439951
Molecular FormulaC16H39NO8Si2
Molecular Weight429.66 g/mol
Exact Mass429.22
IUPAC Name2-(3-trimethoxysilylpropoxy)-N-[2-(3-trimethoxysilylpropoxy)ethyl]ethanamine
SMILESCO[Si](CCCOCCNCCOCCC[Si](OC)(OC)OC)(OC)OC
InChIInChI=1S/C16H39NO8Si2/c1-18-26(19-2,20-3)15-7-11-24-13-9-17-10-14-25-12-8-16-27(21-4,22-5)23-6/h17H,7-16H2,1-6H3
InChIKeyVZDYTMKBKRNAJM-UHFFFAOYSA-N
XLogP1.15
TPSA85.87 Ų
H-Bond Donors1
H-Bond Acceptors9
Rotatable Bonds20
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500429.66
LogP ≤ 51.15
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-(3-trimethoxysilylpropoxy)-N-[2-(3-trimethoxysilylpropoxy)ethyl]ethanamine?
The IUPAC name of 2-(3-trimethoxysilylpropoxy)-N-[2-(3-trimethoxysilylpropoxy)ethyl]ethanamine (CID 141439951) is 2-(3-trimethoxysilylpropoxy)-N-[2-(3-trimethoxysilylpropoxy)ethyl]ethanamine.
What is the SMILES notation for 2-(3-trimethoxysilylpropoxy)-N-[2-(3-trimethoxysilylpropoxy)ethyl]ethanamine?
The canonical SMILES for 2-(3-trimethoxysilylpropoxy)-N-[2-(3-trimethoxysilylpropoxy)ethyl]ethanamine is CO[Si](CCCOCCNCCOCCC[Si](OC)(OC)OC)(OC)OC.
What is the InChIKey of 2-(3-trimethoxysilylpropoxy)-N-[2-(3-trimethoxysilylpropoxy)ethyl]ethanamine?
The InChIKey is VZDYTMKBKRNAJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H39NO8Si2/c1-18-26(19-2,20-3)15-7-11-24-13-9-17-10-14-25-12-8-16-27(21-4,22-5)23-6/h17H,7-16H2,1-6H3.
What are the key properties of 2-(3-trimethoxysilylpropoxy)-N-[2-(3-trimethoxysilylpropoxy)ethyl]ethanamine?
2-(3-trimethoxysilylpropoxy)-N-[2-(3-trimethoxysilylpropoxy)ethyl]ethanamine has a molecular weight of 429.66 g/mol, XLogP of 1.15, 20 rotatable bonds, 1 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-trimethoxysilylpropoxy)-N-[2-(3-trimethoxysilylpropoxy)ethyl]ethanamine is sourced from PubChem (CID 141439951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).