tert-butyl-[[(2S,3R,6S)-3-butyl-6-methoxy-3,6-dihydro-2H-pyran-2-yl]methoxy]-dimethylsilane

C17H34O3Si — CID 10358297

IUPACtert-butyl-[[(2S,3R,6S)-3-butyl-6-methoxy-3,6-dihydro-2H-pyran-2-yl]methoxy]-dimethylsilane
SMILESCCCC[C@@H]1C=C[C@@H](OC)O[C@@H]1CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C17H34O3Si/c1-8-9-10-14-11-12-16(18-5)20-15(14)13-19-21(6,7)17(2,3)4/h11-12,14-16H,8-10,13H2,1-7H3/t14-,15-,16+/m1/s1
InChIKeyAYTMIVXUMULNJD-OAGGEKHMSA-N
MW314.54 g/mol
LogP4.74
Rot. Bonds7

About tert-butyl-[[(2S,3R,6S)-3-butyl-6-methoxy-3,6-dihydro-2H-pyran-2-yl]methoxy]-dimethylsilane

tert-butyl-[[(2S,3R,6S)-3-butyl-6-methoxy-3,6-dihydro-2H-pyran-2-yl]methoxy]-dimethylsilane (PubChem CID 10358297) has the molecular formula C17H34O3Si and a molecular weight of 314.54 g/mol. Its IUPAC name is tert-butyl-[[(2S,3R,6S)-3-butyl-6-methoxy-3,6-dihydro-2H-pyran-2-yl]methoxy]-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[[(2S,3R,6S)-3-butyl-6-methoxy-3,6-dihydro-2H-pyran-2-yl]methoxy]-dimethylsilane
PubChem CID10358297
Molecular FormulaC17H34O3Si
Molecular Weight314.54 g/mol
Exact Mass314.23
IUPAC Nametert-butyl-[[(2S,3R,6S)-3-butyl-6-methoxy-3,6-dihydro-2H-pyran-2-yl]methoxy]-dimethylsilane
SMILESCCCC[C@@H]1C=C[C@@H](OC)O[C@@H]1CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C17H34O3Si/c1-8-9-10-14-11-12-16(18-5)20-15(14)13-19-21(6,7)17(2,3)4/h11-12,14-16H,8-10,13H2,1-7H3/t14-,15-,16+/m1/s1
InChIKeyAYTMIVXUMULNJD-OAGGEKHMSA-N
XLogP4.74
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.54
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': 'isolated_alkene', 'substructure': 'N/A'}

Analyze tert-butyl-[[(2S,3R,6S)-3-butyl-6-methoxy-3,6-dihydro-2H-pyran-2-yl]methoxy]-dimethylsilane 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

tert-butyl-[2-[(1S,5S)-2-[[(2S,6S)-2-(methoxymethoxymethyl)-5-methyl-3,6-dihydro-2H-pyran-6-yl]methyl]-1-methyl-5-propan-2-ylcyclopent-2-en-1-yl]ethoxy]-dimethylsilane
CID 101234070
tert-butyl-[2-[(1S,5S)-2-[[(2S,6R)-2-(methoxymethoxymethyl)-5-methyl-3,6-dihydro-2H-pyran-6-yl]methyl]-1-methyl-5-propan-2-ylcyclopent-2-en-1-yl]ethoxy]-dimethylsilane
CID 134930786
tert-butyl-[(3R,4R,5S)-4-(methoxymethoxy)-5-methylnon-1-en-3-yl]oxy-dimethylsilane
CID 135016313
tert-butyl-[[(3S,6S)-6-ethoxy-3-methyl-3,6-dihydro-2H-pyran-2-yl]methoxy]-dimethylsilane
CID 135037525
Silane, (1,1-dimethylethyl)dimethyl((2-(5-((tetrahydro-2H-pyran-2-yl)oxy)-3-pentenyl)cyclohexyl)oxy)-, (1alpha,2beta(E))-
CID 6442587
2-(2-Cyclohexyl-1-triethylsilyloxyethenyl)-3-methyl-1,4-dioxaspiro[5.4]decane
CID 5377759
Tert-butyl-[4-(1,4-dioxaspiro[4.4]non-8-en-7-yl)butoxy]-dimethylsilane
CID 10892351
tert-butyl-[(E)-5-[5-methoxy-3-[(3E)-3-methylhexa-3,5-dienyl]oxolan-2-yl]-4-methylpent-4-enoxy]-dimethylsilane
CID 140810756
tert-butyl-[(4S,5E,7S,8R,9E)-7-ethyl-8-(methoxymethoxy)-5,9-dimethylundeca-1,5,9-trien-4-yl]oxy-dimethylsilane
CID 149420818
tert-butyl-[(2E,4E,6S,7S,8E,10S,11S)-11-methoxy-6,10-dimethyl-2-[(2R,3R,4S,5R,6S)-3,4,5,6-tetramethoxyoxan-2-yl]trideca-2,4,8-trien-7-yl]oxy-dimethylsilane
CID 155616986
Tert-butyl-[5-[5-methoxy-3-(3-methylhexa-3,5-dienyl)oxolan-2-yl]-4-methylpent-4-enoxy]-dimethylsilane
CID 173624130
tert-butyl-[(E)-5-[(3S)-5-methoxy-3-[(E)-3-methylhept-3-enyl]oxolan-2-yl]-4-methylpent-4-enoxy]-dimethylsilane
CID 173714213

Frequently Asked Questions

What is the IUPAC name of tert-butyl-[[(2S,3R,6S)-3-butyl-6-methoxy-3,6-dihydro-2H-pyran-2-yl]methoxy]-dimethylsilane?
The IUPAC name of tert-butyl-[[(2S,3R,6S)-3-butyl-6-methoxy-3,6-dihydro-2H-pyran-2-yl]methoxy]-dimethylsilane (CID 10358297) is tert-butyl-[[(2S,3R,6S)-3-butyl-6-methoxy-3,6-dihydro-2H-pyran-2-yl]methoxy]-dimethylsilane.
What is the SMILES notation for tert-butyl-[[(2S,3R,6S)-3-butyl-6-methoxy-3,6-dihydro-2H-pyran-2-yl]methoxy]-dimethylsilane?
The canonical SMILES for tert-butyl-[[(2S,3R,6S)-3-butyl-6-methoxy-3,6-dihydro-2H-pyran-2-yl]methoxy]-dimethylsilane is CCCC[C@@H]1C=C[C@@H](OC)O[C@@H]1CO[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-[[(2S,3R,6S)-3-butyl-6-methoxy-3,6-dihydro-2H-pyran-2-yl]methoxy]-dimethylsilane?
The InChIKey is AYTMIVXUMULNJD-OAGGEKHMSA-N. The full InChI is InChI=1S/C17H34O3Si/c1-8-9-10-14-11-12-16(18-5)20-15(14)13-19-21(6,7)17(2,3)4/h11-12,14-16H,8-10,13H2,1-7H3/t14-,15-,16+/m1/s1.
What are the key properties of tert-butyl-[[(2S,3R,6S)-3-butyl-6-methoxy-3,6-dihydro-2H-pyran-2-yl]methoxy]-dimethylsilane?
tert-butyl-[[(2S,3R,6S)-3-butyl-6-methoxy-3,6-dihydro-2H-pyran-2-yl]methoxy]-dimethylsilane has a molecular weight of 314.54 g/mol, XLogP of 4.74, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[[(2S,3R,6S)-3-butyl-6-methoxy-3,6-dihydro-2H-pyran-2-yl]methoxy]-dimethylsilane is sourced from PubChem (CID 10358297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).