2-(4-diethoxysilylbutylamino)ethanol

C10H25NO3Si — CID 173106587

IUPAC2-(4-diethoxysilylbutylamino)ethanol
SMILESCCO[SiH](CCCCNCCO)OCC
InChIInChI=1S/C10H25NO3Si/c1-3-13-15(14-4-2)10-6-5-7-11-8-9-12/h11-12,15H,3-10H2,1-2H3
InChIKeyLDANTXCYSWQVFL-UHFFFAOYSA-N
MW235.40 g/mol
LogP0.64
Rot. Bonds11

About 2-(4-diethoxysilylbutylamino)ethanol

2-(4-diethoxysilylbutylamino)ethanol (PubChem CID 173106587) has the molecular formula C10H25NO3Si and a molecular weight of 235.40 g/mol. Its IUPAC name is 2-(4-diethoxysilylbutylamino)ethanol.

Molecular Properties

Compound Name2-(4-diethoxysilylbutylamino)ethanol
PubChem CID173106587
Molecular FormulaC10H25NO3Si
Molecular Weight235.40 g/mol
Exact Mass235.16
IUPAC Name2-(4-diethoxysilylbutylamino)ethanol
SMILESCCO[SiH](CCCCNCCO)OCC
InChIInChI=1S/C10H25NO3Si/c1-3-13-15(14-4-2)10-6-5-7-11-8-9-12/h11-12,15H,3-10H2,1-2H3
InChIKeyLDANTXCYSWQVFL-UHFFFAOYSA-N
XLogP0.64
TPSA50.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.40
LogP ≤ 50.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2-(4-diethoxysilylbutylamino)ethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(4-diethoxysilylbutylamino)ethanol?
The IUPAC name of 2-(4-diethoxysilylbutylamino)ethanol (CID 173106587) is 2-(4-diethoxysilylbutylamino)ethanol.
What is the SMILES notation for 2-(4-diethoxysilylbutylamino)ethanol?
The canonical SMILES for 2-(4-diethoxysilylbutylamino)ethanol is CCO[SiH](CCCCNCCO)OCC.
What is the InChIKey of 2-(4-diethoxysilylbutylamino)ethanol?
The InChIKey is LDANTXCYSWQVFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H25NO3Si/c1-3-13-15(14-4-2)10-6-5-7-11-8-9-12/h11-12,15H,3-10H2,1-2H3.
What are the key properties of 2-(4-diethoxysilylbutylamino)ethanol?
2-(4-diethoxysilylbutylamino)ethanol has a molecular weight of 235.40 g/mol, XLogP of 0.64, 11 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-diethoxysilylbutylamino)ethanol is sourced from PubChem (CID 173106587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).