2-bicyclo[2.2.1]heptanyl-[[diethoxy(methyl)silyl]methyl]-ethoxy-methylsilane

C16H34O3Si2 — CID 140798694

IUPAC2-bicyclo[2.2.1]heptanyl-[[diethoxy(methyl)silyl]methyl]-ethoxy-methylsilane
SMILESCCO[Si](C)(C[Si](C)(OCC)C1CC2CCC1C2)OCC
InChIInChI=1S/C16H34O3Si2/c1-6-17-20(4,13-21(5,18-7-2)19-8-3)16-12-14-9-10-15(16)11-14/h14-16H,6-13H2,1-5H3
InChIKeyXBMLRALKUPIWAI-UHFFFAOYSA-N
MW330.62 g/mol
LogP4.47
Rot. Bonds9

About 2-bicyclo[2.2.1]heptanyl-[[diethoxy(methyl)silyl]methyl]-ethoxy-methylsilane

2-bicyclo[2.2.1]heptanyl-[[diethoxy(methyl)silyl]methyl]-ethoxy-methylsilane (PubChem CID 140798694) has the molecular formula C16H34O3Si2 and a molecular weight of 330.62 g/mol. Its IUPAC name is 2-bicyclo[2.2.1]heptanyl-[[diethoxy(methyl)silyl]methyl]-ethoxy-methylsilane.

Molecular Properties

Compound Name2-bicyclo[2.2.1]heptanyl-[[diethoxy(methyl)silyl]methyl]-ethoxy-methylsilane
PubChem CID140798694
Molecular FormulaC16H34O3Si2
Molecular Weight330.62 g/mol
Exact Mass330.20
IUPAC Name2-bicyclo[2.2.1]heptanyl-[[diethoxy(methyl)silyl]methyl]-ethoxy-methylsilane
SMILESCCO[Si](C)(C[Si](C)(OCC)C1CC2CCC1C2)OCC
InChIInChI=1S/C16H34O3Si2/c1-6-17-20(4,13-21(5,18-7-2)19-8-3)16-12-14-9-10-15(16)11-14/h14-16H,6-13H2,1-5H3
InChIKeyXBMLRALKUPIWAI-UHFFFAOYSA-N
XLogP4.47
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.62
LogP ≤ 54.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2-bicyclo[2.2.1]heptanyl-[[diethoxy(methyl)silyl]methyl]-ethoxy-methylsilane 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

[(1S,2S,4S)-2-bicyclo[2.2.1]heptanyl]-trimethylsilane
CID 125472918
2-bicyclo[2.2.1]heptanyl-dimethoxy-methylsilane
CID 54452110
[diethoxy(methyl)silyl]methyl-diethoxy-methylsilane
CID 13131406
2-bicyclo[2.2.1]heptanyl-ethynyl-dimethylsilane
CID 15050662
2-bicyclo[2.2.1]heptanyl-dimethoxy-(3-methylbutyl)silane
CID 23439174
4-(2-bicyclo[2.2.1]heptanyl)butyl-triethoxysilane
CID 90386606
[3-(2-bicyclo[2.2.1]heptanyl)-2-bicyclo[2.2.1]heptanyl]-triethoxysilane
CID 90107245
diethoxy-[[ethoxy(dimethyl)silyl]methyl]-methylsilane
CID 58151745
2-bicyclo[2.2.1]heptanyl-dimethoxy-propan-2-ylsilane
CID 175433722
2-bicyclo[2.2.1]heptanylmethoxy-ethenyl-dimethylsilane
CID 69411602
(2-bicyclo[2.2.1]heptanyltetrasulfanyl)-triethoxysilane;cyclohexane
CID 174450081
2-bicyclo[2.2.1]heptanyl-cyclopentyl-dimethoxysilane
CID 139668826

Frequently Asked Questions

What is the IUPAC name of 2-bicyclo[2.2.1]heptanyl-[[diethoxy(methyl)silyl]methyl]-ethoxy-methylsilane?
The IUPAC name of 2-bicyclo[2.2.1]heptanyl-[[diethoxy(methyl)silyl]methyl]-ethoxy-methylsilane (CID 140798694) is 2-bicyclo[2.2.1]heptanyl-[[diethoxy(methyl)silyl]methyl]-ethoxy-methylsilane.
What is the SMILES notation for 2-bicyclo[2.2.1]heptanyl-[[diethoxy(methyl)silyl]methyl]-ethoxy-methylsilane?
The canonical SMILES for 2-bicyclo[2.2.1]heptanyl-[[diethoxy(methyl)silyl]methyl]-ethoxy-methylsilane is CCO[Si](C)(C[Si](C)(OCC)C1CC2CCC1C2)OCC.
What is the InChIKey of 2-bicyclo[2.2.1]heptanyl-[[diethoxy(methyl)silyl]methyl]-ethoxy-methylsilane?
The InChIKey is XBMLRALKUPIWAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34O3Si2/c1-6-17-20(4,13-21(5,18-7-2)19-8-3)16-12-14-9-10-15(16)11-14/h14-16H,6-13H2,1-5H3.
What are the key properties of 2-bicyclo[2.2.1]heptanyl-[[diethoxy(methyl)silyl]methyl]-ethoxy-methylsilane?
2-bicyclo[2.2.1]heptanyl-[[diethoxy(methyl)silyl]methyl]-ethoxy-methylsilane has a molecular weight of 330.62 g/mol, XLogP of 4.47, 9 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bicyclo[2.2.1]heptanyl-[[diethoxy(methyl)silyl]methyl]-ethoxy-methylsilane is sourced from PubChem (CID 140798694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).