2-(5,6-dimethyl-2-bicyclo[2.2.1]heptanyl)ethyl-triethoxysilane

C17H34O3Si — CID 21018762

IUPAC2-(5,6-dimethyl-2-bicyclo[2.2.1]heptanyl)ethyl-triethoxysilane
SMILESCCO[Si](CCC1CC2CC1C(C)C2C)(OCC)OCC
InChIInChI=1S/C17H34O3Si/c1-6-18-21(19-7-2,20-8-3)10-9-15-11-16-12-17(15)14(5)13(16)4/h13-17H,6-12H2,1-5H3
InChIKeyPSJJSTBKCJPBGY-UHFFFAOYSA-N
MW314.54 g/mol
LogP4.35
Rot. Bonds9

About 2-(5,6-dimethyl-2-bicyclo[2.2.1]heptanyl)ethyl-triethoxysilane

2-(5,6-dimethyl-2-bicyclo[2.2.1]heptanyl)ethyl-triethoxysilane (PubChem CID 21018762) has the molecular formula C17H34O3Si and a molecular weight of 314.54 g/mol. Its IUPAC name is 2-(5,6-dimethyl-2-bicyclo[2.2.1]heptanyl)ethyl-triethoxysilane.

Molecular Properties

Compound Name2-(5,6-dimethyl-2-bicyclo[2.2.1]heptanyl)ethyl-triethoxysilane
PubChem CID21018762
Molecular FormulaC17H34O3Si
Molecular Weight314.54 g/mol
Exact Mass314.23
IUPAC Name2-(5,6-dimethyl-2-bicyclo[2.2.1]heptanyl)ethyl-triethoxysilane
SMILESCCO[Si](CCC1CC2CC1C(C)C2C)(OCC)OCC
InChIInChI=1S/C17H34O3Si/c1-6-18-21(19-7-2,20-8-3)10-9-15-11-16-12-17(15)14(5)13(16)4/h13-17H,6-12H2,1-5H3
InChIKeyPSJJSTBKCJPBGY-UHFFFAOYSA-N
XLogP4.35
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.54
LogP ≤ 54.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2-(5,6-dimethyl-2-bicyclo[2.2.1]heptanyl)ethyl-triethoxysilane 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

dichloro-(5,6-dimethyl-2-bicyclo[2.2.1]heptanyl)-methylsilane;(5,6-dimethyl-2-bicyclo[2.2.1]heptanyl)-dimethoxy-methylsilane;2-(5,6-dimethyl-2-bicyclo[2.2.1]heptanyl)ethyl-dimethoxy-methylsilane;2-(5,6-dimethyl-2-bicyclo[2.2.1]heptanyl)ethyl-triethoxysilane;2-(5,6-dimethyl-2-bicyclo[2.2.1]heptanyl)ethyl-trimethoxysilane;(5,6-dimethyl-2-bicyclo[2.2.1]heptanyl)-methoxy-dimethylsilane;(5,6-dimethyl-2-bicyclo[2.2.1]heptanyl)methyl-dimethoxy-methylsilane;(5,6-dimethyl-2-bicyclo[2.2.1]heptanyl)methyl-triethoxysilane;(5,6-dimethyl-2-bicyclo[2.2.1]heptanyl)methyl-trimethoxysilane;(5,6-dimethyl-2-bicyclo[2.2.1]heptanyl)-triethoxysilane;(5,6-dimethyl-2-bicyclo[2.2.1]heptanyl)-trimethoxysilane
CID 162140016
2-[(1R,2R,4R)-2-bicyclo[2.2.1]hept-5-enyl]ethyl-triethoxysilane
CID 124925724
1-(5,6-dimethyl-2-bicyclo[2.2.1]heptanyl)-7-ethoxyheptan-4-ol
CID 21361769
(5,6-dimethyl-2-bicyclo[2.2.1]heptanyl)methoxy-methyl-diphenylsilane
CID 58518805
trimethylsilyl 2-(5,6-dimethyl-2-bicyclo[2.2.1]heptanyl)acetate
CID 23381998
[(1R,4R)-5,6-dimethyl-2-bicyclo[2.2.1]heptanyl]methyl butanoate
CID 70995611
4-(2-bicyclo[2.2.1]heptanyl)butyl-triethoxysilane
CID 90386606
2-(5,6-dimethyl-2-bicyclo[2.2.1]heptanyl)-1-fluoroethanol
CID 23405415
2-methoxy-4-(2-triethoxysilylethyl)cyclohexan-1-ol
CID 141485190
triethoxy-[3-[2-[2-(2-triethoxysilylethyl)-5-[2-(3-triethoxysilylpropyldisulfanyl)ethyl]cyclohexyl]ethyldisulfanyl]propyl]silane
CID 87112069
triethoxy-[2-[(1R,3R,6S)-7-oxabicyclo[4.1.0]heptan-3-yl]ethyl]silane
CID 99738442
2-(7-azabicyclo[4.1.0]heptan-3-yl)ethyl-triethoxysilane
CID 156703702

Frequently Asked Questions

What is the IUPAC name of 2-(5,6-dimethyl-2-bicyclo[2.2.1]heptanyl)ethyl-triethoxysilane?
The IUPAC name of 2-(5,6-dimethyl-2-bicyclo[2.2.1]heptanyl)ethyl-triethoxysilane (CID 21018762) is 2-(5,6-dimethyl-2-bicyclo[2.2.1]heptanyl)ethyl-triethoxysilane.
What is the SMILES notation for 2-(5,6-dimethyl-2-bicyclo[2.2.1]heptanyl)ethyl-triethoxysilane?
The canonical SMILES for 2-(5,6-dimethyl-2-bicyclo[2.2.1]heptanyl)ethyl-triethoxysilane is CCO[Si](CCC1CC2CC1C(C)C2C)(OCC)OCC.
What is the InChIKey of 2-(5,6-dimethyl-2-bicyclo[2.2.1]heptanyl)ethyl-triethoxysilane?
The InChIKey is PSJJSTBKCJPBGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34O3Si/c1-6-18-21(19-7-2,20-8-3)10-9-15-11-16-12-17(15)14(5)13(16)4/h13-17H,6-12H2,1-5H3.
What are the key properties of 2-(5,6-dimethyl-2-bicyclo[2.2.1]heptanyl)ethyl-triethoxysilane?
2-(5,6-dimethyl-2-bicyclo[2.2.1]heptanyl)ethyl-triethoxysilane has a molecular weight of 314.54 g/mol, XLogP of 4.35, 9 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5,6-dimethyl-2-bicyclo[2.2.1]heptanyl)ethyl-triethoxysilane is sourced from PubChem (CID 21018762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).