[1,1-diethoxy-5-(oxiran-2-yl)pentyl]silane

C11H24O3Si — CID 174996885

IUPAC[1,1-diethoxy-5-(oxiran-2-yl)pentyl]silane
SMILESCCOC([SiH3])(CCCCC1CO1)OCC
InChIInChI=1S/C11H24O3Si/c1-3-13-11(15,14-4-2)8-6-5-7-10-9-12-10/h10H,3-9H2,1-2,15H3
InChIKeyFPBPVWHEOMUMFS-UHFFFAOYSA-N
MW232.40 g/mol
LogP1.04
Rot. Bonds9

About [1,1-diethoxy-5-(oxiran-2-yl)pentyl]silane

[1,1-diethoxy-5-(oxiran-2-yl)pentyl]silane (PubChem CID 174996885) has the molecular formula C11H24O3Si and a molecular weight of 232.40 g/mol. Its IUPAC name is [1,1-diethoxy-5-(oxiran-2-yl)pentyl]silane.

Molecular Properties

Compound Name[1,1-diethoxy-5-(oxiran-2-yl)pentyl]silane
PubChem CID174996885
Molecular FormulaC11H24O3Si
Molecular Weight232.40 g/mol
Exact Mass232.15
IUPAC Name[1,1-diethoxy-5-(oxiran-2-yl)pentyl]silane
SMILESCCOC([SiH3])(CCCCC1CO1)OCC
InChIInChI=1S/C11H24O3Si/c1-3-13-11(15,14-4-2)8-6-5-7-10-9-12-10/h10H,3-9H2,1-2,15H3
InChIKeyFPBPVWHEOMUMFS-UHFFFAOYSA-N
XLogP1.04
TPSA30.99 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.40
LogP ≤ 51.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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'}, {'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

Analyze [1,1-diethoxy-5-(oxiran-2-yl)pentyl]silane 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 [1,1-diethoxy-5-(oxiran-2-yl)pentyl]silane?
The IUPAC name of [1,1-diethoxy-5-(oxiran-2-yl)pentyl]silane (CID 174996885) is [1,1-diethoxy-5-(oxiran-2-yl)pentyl]silane.
What is the SMILES notation for [1,1-diethoxy-5-(oxiran-2-yl)pentyl]silane?
The canonical SMILES for [1,1-diethoxy-5-(oxiran-2-yl)pentyl]silane is CCOC([SiH3])(CCCCC1CO1)OCC.
What is the InChIKey of [1,1-diethoxy-5-(oxiran-2-yl)pentyl]silane?
The InChIKey is FPBPVWHEOMUMFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24O3Si/c1-3-13-11(15,14-4-2)8-6-5-7-10-9-12-10/h10H,3-9H2,1-2,15H3.
What are the key properties of [1,1-diethoxy-5-(oxiran-2-yl)pentyl]silane?
[1,1-diethoxy-5-(oxiran-2-yl)pentyl]silane has a molecular weight of 232.40 g/mol, XLogP of 1.04, 9 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1,1-diethoxy-5-(oxiran-2-yl)pentyl]silane is sourced from PubChem (CID 174996885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).