diethoxy(2-phenylbutyl)silane

C14H24O2Si — CID 173370205

IUPACdiethoxy(2-phenylbutyl)silane
SMILESCCO[SiH](CC(CC)c1ccccc1)OCC
InChIInChI=1S/C14H24O2Si/c1-4-13(14-10-8-7-9-11-14)12-17(15-5-2)16-6-3/h7-11,13,17H,4-6,12H2,1-3H3
InChIKeyBGSZLLLYHNQSLU-UHFFFAOYSA-N
MW252.43 g/mol
LogP3.47
Rot. Bonds8

About diethoxy(2-phenylbutyl)silane

diethoxy(2-phenylbutyl)silane (PubChem CID 173370205) has the molecular formula C14H24O2Si and a molecular weight of 252.43 g/mol. Its IUPAC name is diethoxy(2-phenylbutyl)silane.

Molecular Properties

Compound Namediethoxy(2-phenylbutyl)silane
PubChem CID173370205
Molecular FormulaC14H24O2Si
Molecular Weight252.43 g/mol
Exact Mass252.15
IUPAC Namediethoxy(2-phenylbutyl)silane
SMILESCCO[SiH](CC(CC)c1ccccc1)OCC
InChIInChI=1S/C14H24O2Si/c1-4-13(14-10-8-7-9-11-14)12-17(15-5-2)16-6-3/h7-11,13,17H,4-6,12H2,1-3H3
InChIKeyBGSZLLLYHNQSLU-UHFFFAOYSA-N
XLogP3.47
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.43
LogP ≤ 53.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze diethoxy(2-phenylbutyl)silane 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

azane;pentan-3-ylbenzene
CID 19774895
5-phenylheptan-2-amine
CID 83936540
hydrogen peroxide;1-phenylbutan-2-ylbenzene
CID 19777291
pentan-3-ylbenzene;selenic acid
CID 175520254
heptan-3-ylbenzene;methane
CID 159006232
octan-3-ylbenzene
CID 519547
ethane;methane;5-methylheptan-3-ylbenzene
CID 168921698
(1-fluoro-1-phenylpentan-3-yl)benzene
CID 150013028
(3R)-3-phenylpentanal
CID 12598589
ethane;3-phenylpentanoic acid
CID 142147200
N-(2-ethoxyethyl)-N-methyl-2-phenylbutan-1-amine
CID 71031505
4,4,5,5-tetramethyl-2-[(2R)-2-phenylbutyl]-1,3,2-dioxaborolane
CID 54597883

Frequently Asked Questions

What is the IUPAC name of diethoxy(2-phenylbutyl)silane?
The IUPAC name of diethoxy(2-phenylbutyl)silane (CID 173370205) is diethoxy(2-phenylbutyl)silane.
What is the SMILES notation for diethoxy(2-phenylbutyl)silane?
The canonical SMILES for diethoxy(2-phenylbutyl)silane is CCO[SiH](CC(CC)c1ccccc1)OCC.
What is the InChIKey of diethoxy(2-phenylbutyl)silane?
The InChIKey is BGSZLLLYHNQSLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24O2Si/c1-4-13(14-10-8-7-9-11-14)12-17(15-5-2)16-6-3/h7-11,13,17H,4-6,12H2,1-3H3.
What are the key properties of diethoxy(2-phenylbutyl)silane?
diethoxy(2-phenylbutyl)silane has a molecular weight of 252.43 g/mol, XLogP of 3.47, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for diethoxy(2-phenylbutyl)silane is sourced from PubChem (CID 173370205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).