diethoxymethylsilane;propane

C8H22O2Si — CID 174925754

IUPACdiethoxymethylsilane;propane
SMILESCCC.CCOC([SiH3])OCC
InChIInChI=1S/C5H14O2Si.C3H8/c1-3-6-5(8)7-4-2;1-3-2/h5H,3-4H2,1-2,8H3;3H2,1-2H3
InChIKeyNNUWZPROQWXQIN-UHFFFAOYSA-N
MW178.35 g/mol
LogP1.12
Rot. Bonds4

About diethoxymethylsilane;propane

diethoxymethylsilane;propane (PubChem CID 174925754) has the molecular formula C8H22O2Si and a molecular weight of 178.35 g/mol. Its IUPAC name is diethoxymethylsilane;propane.

Molecular Properties

Compound Namediethoxymethylsilane;propane
PubChem CID174925754
Molecular FormulaC8H22O2Si
Molecular Weight178.35 g/mol
Exact Mass178.14
IUPAC Namediethoxymethylsilane;propane
SMILESCCC.CCOC([SiH3])OCC
InChIInChI=1S/C5H14O2Si.C3H8/c1-3-6-5(8)7-4-2;1-3-2/h5H,3-4H2,1-2,8H3;3H2,1-2H3
InChIKeyNNUWZPROQWXQIN-UHFFFAOYSA-N
XLogP1.12
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.35
LogP ≤ 51.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze diethoxymethylsilane;propane with MolForge

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

Launch Full Analysis

Related Compounds

diethoxymethylsilane;dimethyl-octadecyl-propylazanium
CID 174982046
1-(azetidin-3-yl)ethanamine;diethoxymethylsilane
CID 173107228
bis(2-methylpropoxy)methylsilane
CID 123767341
1,1-diethoxyethane
CID 7765
didodecoxymethylsilane
CID 172799979
1-ethoxy-1-methylsulfanylethane
CID 18710050
propane;ruthenium
CID 161061794
1-(1-ethoxyethoxy)propylsilane
CID 175194078
1,1-diethoxyethane;sulfane
CID 87563963
diethoxymethanamine;hydrochloride
CID 175125355
CID 165175162
CID 165175162
1,1-diethoxyethane;stannane
CID 87529398

Frequently Asked Questions

What is the IUPAC name of diethoxymethylsilane;propane?
The IUPAC name of diethoxymethylsilane;propane (CID 174925754) is diethoxymethylsilane;propane.
What is the SMILES notation for diethoxymethylsilane;propane?
The canonical SMILES for diethoxymethylsilane;propane is CCC.CCOC([SiH3])OCC.
What is the InChIKey of diethoxymethylsilane;propane?
The InChIKey is NNUWZPROQWXQIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H14O2Si.C3H8/c1-3-6-5(8)7-4-2;1-3-2/h5H,3-4H2,1-2,8H3;3H2,1-2H3.
What are the key properties of diethoxymethylsilane;propane?
diethoxymethylsilane;propane has a molecular weight of 178.35 g/mol, XLogP of 1.12, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for diethoxymethylsilane;propane is sourced from PubChem (CID 174925754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).