tert-butyl-[3-(2-methoxypropan-2-yloxy)-4-methylpent-4-enoxy]-dimethylsilane

C16H34O3Si — CID 102514291

IUPACtert-butyl-[3-(2-methoxypropan-2-yloxy)-4-methylpent-4-enoxy]-dimethylsilane
SMILESC=C(C)C(CCO[Si](C)(C)C(C)(C)C)OC(C)(C)OC
InChIInChI=1S/C16H34O3Si/c1-13(2)14(19-16(6,7)17-8)11-12-18-20(9,10)15(3,4)5/h14H,1,11-12H2,2-10H3
InChIKeyDPNKLKVZZGLKKW-UHFFFAOYSA-N
MW302.53 g/mol
LogP4.74
Rot. Bonds8

About tert-butyl-[3-(2-methoxypropan-2-yloxy)-4-methylpent-4-enoxy]-dimethylsilane

tert-butyl-[3-(2-methoxypropan-2-yloxy)-4-methylpent-4-enoxy]-dimethylsilane (PubChem CID 102514291) has the molecular formula C16H34O3Si and a molecular weight of 302.53 g/mol. Its IUPAC name is tert-butyl-[3-(2-methoxypropan-2-yloxy)-4-methylpent-4-enoxy]-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[3-(2-methoxypropan-2-yloxy)-4-methylpent-4-enoxy]-dimethylsilane
PubChem CID102514291
Molecular FormulaC16H34O3Si
Molecular Weight302.53 g/mol
Exact Mass302.23
IUPAC Nametert-butyl-[3-(2-methoxypropan-2-yloxy)-4-methylpent-4-enoxy]-dimethylsilane
SMILESC=C(C)C(CCO[Si](C)(C)C(C)(C)C)OC(C)(C)OC
InChIInChI=1S/C16H34O3Si/c1-13(2)14(19-16(6,7)17-8)11-12-18-20(9,10)15(3,4)5/h14H,1,11-12H2,2-10H3
InChIKeyDPNKLKVZZGLKKW-UHFFFAOYSA-N
XLogP4.74
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.53
LogP ≤ 54.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze tert-butyl-[3-(2-methoxypropan-2-yloxy)-4-methylpent-4-enoxy]-dimethylsilane 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 tert-butyl-[3-(2-methoxypropan-2-yloxy)-4-methylpent-4-enoxy]-dimethylsilane?
The IUPAC name of tert-butyl-[3-(2-methoxypropan-2-yloxy)-4-methylpent-4-enoxy]-dimethylsilane (CID 102514291) is tert-butyl-[3-(2-methoxypropan-2-yloxy)-4-methylpent-4-enoxy]-dimethylsilane.
What is the SMILES notation for tert-butyl-[3-(2-methoxypropan-2-yloxy)-4-methylpent-4-enoxy]-dimethylsilane?
The canonical SMILES for tert-butyl-[3-(2-methoxypropan-2-yloxy)-4-methylpent-4-enoxy]-dimethylsilane is C=C(C)C(CCO[Si](C)(C)C(C)(C)C)OC(C)(C)OC.
What is the InChIKey of tert-butyl-[3-(2-methoxypropan-2-yloxy)-4-methylpent-4-enoxy]-dimethylsilane?
The InChIKey is DPNKLKVZZGLKKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34O3Si/c1-13(2)14(19-16(6,7)17-8)11-12-18-20(9,10)15(3,4)5/h14H,1,11-12H2,2-10H3.
What are the key properties of tert-butyl-[3-(2-methoxypropan-2-yloxy)-4-methylpent-4-enoxy]-dimethylsilane?
tert-butyl-[3-(2-methoxypropan-2-yloxy)-4-methylpent-4-enoxy]-dimethylsilane has a molecular weight of 302.53 g/mol, XLogP of 4.74, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[3-(2-methoxypropan-2-yloxy)-4-methylpent-4-enoxy]-dimethylsilane is sourced from PubChem (CID 102514291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).