2-(diethoxymethoxysilyl)ethanamine

C7H19NO3Si — CID 123825582

IUPAC2-(diethoxymethoxysilyl)ethanamine
SMILESCCOC(OCC)O[SiH2]CCN
InChIInChI=1S/C7H19NO3Si/c1-3-9-7(10-4-2)11-12-6-5-8/h7H,3-6,8,12H2,1-2H3
InChIKeyXCHJISWYSPDMBP-UHFFFAOYSA-N
MW193.32 g/mol
LogP-0.18
Rot. Bonds8

About 2-(diethoxymethoxysilyl)ethanamine

2-(diethoxymethoxysilyl)ethanamine (PubChem CID 123825582) has the molecular formula C7H19NO3Si and a molecular weight of 193.32 g/mol. Its IUPAC name is 2-(diethoxymethoxysilyl)ethanamine.

Molecular Properties

Compound Name2-(diethoxymethoxysilyl)ethanamine
PubChem CID123825582
Molecular FormulaC7H19NO3Si
Molecular Weight193.32 g/mol
Exact Mass193.11
IUPAC Name2-(diethoxymethoxysilyl)ethanamine
SMILESCCOC(OCC)O[SiH2]CCN
InChIInChI=1S/C7H19NO3Si/c1-3-9-7(10-4-2)11-12-6-5-8/h7H,3-6,8,12H2,1-2H3
InChIKeyXCHJISWYSPDMBP-UHFFFAOYSA-N
XLogP-0.18
TPSA53.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.32
LogP ≤ 5-0.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(diethoxymethoxysilyl)ethanamine?
The IUPAC name of 2-(diethoxymethoxysilyl)ethanamine (CID 123825582) is 2-(diethoxymethoxysilyl)ethanamine.
What is the SMILES notation for 2-(diethoxymethoxysilyl)ethanamine?
The canonical SMILES for 2-(diethoxymethoxysilyl)ethanamine is CCOC(OCC)O[SiH2]CCN.
What is the InChIKey of 2-(diethoxymethoxysilyl)ethanamine?
The InChIKey is XCHJISWYSPDMBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H19NO3Si/c1-3-9-7(10-4-2)11-12-6-5-8/h7H,3-6,8,12H2,1-2H3.
What are the key properties of 2-(diethoxymethoxysilyl)ethanamine?
2-(diethoxymethoxysilyl)ethanamine has a molecular weight of 193.32 g/mol, XLogP of -0.18, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(diethoxymethoxysilyl)ethanamine is sourced from PubChem (CID 123825582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).