2-bicyclo[2.2.1]hept-5-enylmethoxy-tri(propan-2-yl)silane

C17H32OSi — CID 100919043

IUPAC2-bicyclo[2.2.1]hept-5-enylmethoxy-tri(propan-2-yl)silane
SMILESCC(C)[Si](OCC1CC2C=CC1C2)(C(C)C)C(C)C
InChIInChI=1S/C17H32OSi/c1-12(2)19(13(3)4,14(5)6)18-11-17-10-15-7-8-16(17)9-15/h7-8,12-17H,9-11H2,1-6H3
InChIKeyBFGRQYRLZQPNJZ-UHFFFAOYSA-N
MW280.53 g/mol
LogP5.39
Rot. Bonds6

About 2-bicyclo[2.2.1]hept-5-enylmethoxy-tri(propan-2-yl)silane

2-bicyclo[2.2.1]hept-5-enylmethoxy-tri(propan-2-yl)silane (PubChem CID 100919043) has the molecular formula C17H32OSi and a molecular weight of 280.53 g/mol. Its IUPAC name is 2-bicyclo[2.2.1]hept-5-enylmethoxy-tri(propan-2-yl)silane.

Molecular Properties

Compound Name2-bicyclo[2.2.1]hept-5-enylmethoxy-tri(propan-2-yl)silane
PubChem CID100919043
Molecular FormulaC17H32OSi
Molecular Weight280.53 g/mol
Exact Mass280.22
IUPAC Name2-bicyclo[2.2.1]hept-5-enylmethoxy-tri(propan-2-yl)silane
SMILESCC(C)[Si](OCC1CC2C=CC1C2)(C(C)C)C(C)C
InChIInChI=1S/C17H32OSi/c1-12(2)19(13(3)4,14(5)6)18-11-17-10-15-7-8-16(17)9-15/h7-8,12-17H,9-11H2,1-6H3
InChIKeyBFGRQYRLZQPNJZ-UHFFFAOYSA-N
XLogP5.39
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500280.53
LogP ≤ 55.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 2-bicyclo[2.2.1]hept-5-enylmethoxy-tri(propan-2-yl)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

2-bicyclo[2.2.1]hept-5-enylmethyl-ethoxy-di(propan-2-yl)silane
CID 22229016
[(1S,2S,4S)-2-bicyclo[2.2.1]hept-5-enyl]methoxy-tert-butyl-dimethylsilane
CID 11436362
[(1R,4R)-2-bicyclo[2.2.1]hept-5-enyl]methoxy-dimethylalumane
CID 16687358
5-(2-methylpropyl)bicyclo[2.2.1]hept-2-ene
CID 21079931
bis(2-bicyclo[2.2.1]hept-5-enylmethoxy)-diphenylsilane
CID 22983009
2-[(1R,2R,4R)-2-bicyclo[2.2.1]hept-5-enyl]ethyl-triethoxysilane
CID 124925724
2-bicyclo[2.2.1]hept-5-enylmethoxy-ethyl-methyl-phenylsilane
CID 140775718
2-bicyclo[2.2.1]hept-5-enylmethoxy(diethyl)silane
CID 123661462
5-(2-methoxyethoxymethyl)bicyclo[2.2.1]hept-2-ene
CID 59169045
(1S,4S,5R)-5-ethylbicyclo[2.2.1]hept-2-ene
CID 96570682
CID 123207984
CID 123207984
5-[2-(2-bicyclo[2.2.1]hept-5-enyl)ethyl]bicyclo[2.2.1]hept-2-ene
CID 160903518

Frequently Asked Questions

What is the IUPAC name of 2-bicyclo[2.2.1]hept-5-enylmethoxy-tri(propan-2-yl)silane?
The IUPAC name of 2-bicyclo[2.2.1]hept-5-enylmethoxy-tri(propan-2-yl)silane (CID 100919043) is 2-bicyclo[2.2.1]hept-5-enylmethoxy-tri(propan-2-yl)silane.
What is the SMILES notation for 2-bicyclo[2.2.1]hept-5-enylmethoxy-tri(propan-2-yl)silane?
The canonical SMILES for 2-bicyclo[2.2.1]hept-5-enylmethoxy-tri(propan-2-yl)silane is CC(C)[Si](OCC1CC2C=CC1C2)(C(C)C)C(C)C.
What is the InChIKey of 2-bicyclo[2.2.1]hept-5-enylmethoxy-tri(propan-2-yl)silane?
The InChIKey is BFGRQYRLZQPNJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32OSi/c1-12(2)19(13(3)4,14(5)6)18-11-17-10-15-7-8-16(17)9-15/h7-8,12-17H,9-11H2,1-6H3.
What are the key properties of 2-bicyclo[2.2.1]hept-5-enylmethoxy-tri(propan-2-yl)silane?
2-bicyclo[2.2.1]hept-5-enylmethoxy-tri(propan-2-yl)silane has a molecular weight of 280.53 g/mol, XLogP of 5.39, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bicyclo[2.2.1]hept-5-enylmethoxy-tri(propan-2-yl)silane is sourced from PubChem (CID 100919043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).