cyclopentylmethyl-(2-ethylhexyl)-dimethoxysilane

C16H34O2Si — CID 18412956

IUPACcyclopentylmethyl-(2-ethylhexyl)-dimethoxysilane
SMILESCCCCC(CC)C[Si](CC1CCCC1)(OC)OC
InChIInChI=1S/C16H34O2Si/c1-5-7-10-15(6-2)13-19(17-3,18-4)14-16-11-8-9-12-16/h15-16H,5-14H2,1-4H3
InChIKeyJXXWXQNOBZHVQN-UHFFFAOYSA-N
MW286.53 g/mol
LogP5.13
Rot. Bonds10

About cyclopentylmethyl-(2-ethylhexyl)-dimethoxysilane

cyclopentylmethyl-(2-ethylhexyl)-dimethoxysilane (PubChem CID 18412956) has the molecular formula C16H34O2Si and a molecular weight of 286.53 g/mol. Its IUPAC name is cyclopentylmethyl-(2-ethylhexyl)-dimethoxysilane.

Molecular Properties

Compound Namecyclopentylmethyl-(2-ethylhexyl)-dimethoxysilane
PubChem CID18412956
Molecular FormulaC16H34O2Si
Molecular Weight286.53 g/mol
Exact Mass286.23
IUPAC Namecyclopentylmethyl-(2-ethylhexyl)-dimethoxysilane
SMILESCCCCC(CC)C[Si](CC1CCCC1)(OC)OC
InChIInChI=1S/C16H34O2Si/c1-5-7-10-15(6-2)13-19(17-3,18-4)14-16-11-8-9-12-16/h15-16H,5-14H2,1-4H3
InChIKeyJXXWXQNOBZHVQN-UHFFFAOYSA-N
XLogP5.13
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500286.53
LogP ≤ 55.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze cyclopentylmethyl-(2-ethylhexyl)-dimethoxysilane 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 cyclopentylmethyl-(2-ethylhexyl)-dimethoxysilane?
The IUPAC name of cyclopentylmethyl-(2-ethylhexyl)-dimethoxysilane (CID 18412956) is cyclopentylmethyl-(2-ethylhexyl)-dimethoxysilane.
What is the SMILES notation for cyclopentylmethyl-(2-ethylhexyl)-dimethoxysilane?
The canonical SMILES for cyclopentylmethyl-(2-ethylhexyl)-dimethoxysilane is CCCCC(CC)C[Si](CC1CCCC1)(OC)OC.
What is the InChIKey of cyclopentylmethyl-(2-ethylhexyl)-dimethoxysilane?
The InChIKey is JXXWXQNOBZHVQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34O2Si/c1-5-7-10-15(6-2)13-19(17-3,18-4)14-16-11-8-9-12-16/h15-16H,5-14H2,1-4H3.
What are the key properties of cyclopentylmethyl-(2-ethylhexyl)-dimethoxysilane?
cyclopentylmethyl-(2-ethylhexyl)-dimethoxysilane has a molecular weight of 286.53 g/mol, XLogP of 5.13, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopentylmethyl-(2-ethylhexyl)-dimethoxysilane is sourced from PubChem (CID 18412956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).