cyclopentyl-diethoxy-(3-methylbutyl)silane

C14H30O2Si — CID 23439172

IUPACcyclopentyl-diethoxy-(3-methylbutyl)silane
SMILESCCO[Si](CCC(C)C)(OCC)C1CCCC1
InChIInChI=1S/C14H30O2Si/c1-5-15-17(16-6-2,12-11-13(3)4)14-9-7-8-10-14/h13-14H,5-12H2,1-4H3
InChIKeyYHFCLGBBHPZIGL-UHFFFAOYSA-N
MW258.48 g/mol
LogP4.49
Rot. Bonds8

About cyclopentyl-diethoxy-(3-methylbutyl)silane

cyclopentyl-diethoxy-(3-methylbutyl)silane (PubChem CID 23439172) has the molecular formula C14H30O2Si and a molecular weight of 258.48 g/mol. Its IUPAC name is cyclopentyl-diethoxy-(3-methylbutyl)silane.

Molecular Properties

Compound Namecyclopentyl-diethoxy-(3-methylbutyl)silane
PubChem CID23439172
Molecular FormulaC14H30O2Si
Molecular Weight258.48 g/mol
Exact Mass258.20
IUPAC Namecyclopentyl-diethoxy-(3-methylbutyl)silane
SMILESCCO[Si](CCC(C)C)(OCC)C1CCCC1
InChIInChI=1S/C14H30O2Si/c1-5-15-17(16-6-2,12-11-13(3)4)14-9-7-8-10-14/h13-14H,5-12H2,1-4H3
InChIKeyYHFCLGBBHPZIGL-UHFFFAOYSA-N
XLogP4.49
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.48
LogP ≤ 54.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of cyclopentyl-diethoxy-(3-methylbutyl)silane?
The IUPAC name of cyclopentyl-diethoxy-(3-methylbutyl)silane (CID 23439172) is cyclopentyl-diethoxy-(3-methylbutyl)silane.
What is the SMILES notation for cyclopentyl-diethoxy-(3-methylbutyl)silane?
The canonical SMILES for cyclopentyl-diethoxy-(3-methylbutyl)silane is CCO[Si](CCC(C)C)(OCC)C1CCCC1.
What is the InChIKey of cyclopentyl-diethoxy-(3-methylbutyl)silane?
The InChIKey is YHFCLGBBHPZIGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30O2Si/c1-5-15-17(16-6-2,12-11-13(3)4)14-9-7-8-10-14/h13-14H,5-12H2,1-4H3.
What are the key properties of cyclopentyl-diethoxy-(3-methylbutyl)silane?
cyclopentyl-diethoxy-(3-methylbutyl)silane has a molecular weight of 258.48 g/mol, XLogP of 4.49, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopentyl-diethoxy-(3-methylbutyl)silane is sourced from PubChem (CID 23439172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).