tert-butyl-[4-[tert-butyl(dimethyl)silyl]oxypiperidin-4-yl]oxy-dimethylsilane

C17H39NO2Si2 — CID 141193020

IUPACtert-butyl-[4-[tert-butyl(dimethyl)silyl]oxypiperidin-4-yl]oxy-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)OC1(O[Si](C)(C)C(C)(C)C)CCNCC1
InChIInChI=1S/C17H39NO2Si2/c1-15(2,3)21(7,8)19-17(11-13-18-14-12-17)20-22(9,10)16(4,5)6/h18H,11-14H2,1-10H3
InChIKeyZFPRWXMWXGFZIN-UHFFFAOYSA-N
MW345.68 g/mol
LogP5.11
Rot. Bonds4

About tert-butyl-[4-[tert-butyl(dimethyl)silyl]oxypiperidin-4-yl]oxy-dimethylsilane

tert-butyl-[4-[tert-butyl(dimethyl)silyl]oxypiperidin-4-yl]oxy-dimethylsilane (PubChem CID 141193020) has the molecular formula C17H39NO2Si2 and a molecular weight of 345.68 g/mol. Its IUPAC name is tert-butyl-[4-[tert-butyl(dimethyl)silyl]oxypiperidin-4-yl]oxy-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[4-[tert-butyl(dimethyl)silyl]oxypiperidin-4-yl]oxy-dimethylsilane
PubChem CID141193020
Molecular FormulaC17H39NO2Si2
Molecular Weight345.68 g/mol
Exact Mass345.25
IUPAC Nametert-butyl-[4-[tert-butyl(dimethyl)silyl]oxypiperidin-4-yl]oxy-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)OC1(O[Si](C)(C)C(C)(C)C)CCNCC1
InChIInChI=1S/C17H39NO2Si2/c1-15(2,3)21(7,8)19-17(11-13-18-14-12-17)20-22(9,10)16(4,5)6/h18H,11-14H2,1-10H3
InChIKeyZFPRWXMWXGFZIN-UHFFFAOYSA-N
XLogP5.11
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500345.68
LogP ≤ 55.11
H-Bond Donors ≤ 51
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'}

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Related Compounds

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CID 557469
tert-butyl-[1-(4-fluoro-3-piperazin-1-ylphenyl)cyclopropyl]oxy-dimethylsilane
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CID 178035072
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tert-butyl-[[4-(methoxymethyl)-1-bicyclo[2.2.1]heptanyl]oxy]-dimethylsilane
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2-[tert-butyl(dimethyl)silyl]oxy-2-methylcyclohexan-1-one
CID 67592134
tert-butyl-dimethyl-[[(1S,2R,6R)-2-methyl-7-oxabicyclo[4.1.0]heptan-2-yl]oxy]silane
CID 88548685
tert-butyl-[(4,4-difluoropiperidin-3-yl)methoxy]-dimethylsilane
CID 164874047
tert-butyl-dimethyl-(1-methyl-4-propan-2-ylcyclohexyl)oxysilane
CID 22447738
tert-butyl-(1,3-dimethylcyclobutyl)oxy-dimethylsilane
CID 174101366
1-[1-[tert-butyl(dimethyl)silyl]oxycyclopropyl]propan-2-one
CID 123838797
tert-butyl-dimethyl-(7-oxabicyclo[4.1.0]heptan-1-yloxy)silane
CID 102386072

Frequently Asked Questions

What is the IUPAC name of tert-butyl-[4-[tert-butyl(dimethyl)silyl]oxypiperidin-4-yl]oxy-dimethylsilane?
The IUPAC name of tert-butyl-[4-[tert-butyl(dimethyl)silyl]oxypiperidin-4-yl]oxy-dimethylsilane (CID 141193020) is tert-butyl-[4-[tert-butyl(dimethyl)silyl]oxypiperidin-4-yl]oxy-dimethylsilane.
What is the SMILES notation for tert-butyl-[4-[tert-butyl(dimethyl)silyl]oxypiperidin-4-yl]oxy-dimethylsilane?
The canonical SMILES for tert-butyl-[4-[tert-butyl(dimethyl)silyl]oxypiperidin-4-yl]oxy-dimethylsilane is CC(C)(C)[Si](C)(C)OC1(O[Si](C)(C)C(C)(C)C)CCNCC1.
What is the InChIKey of tert-butyl-[4-[tert-butyl(dimethyl)silyl]oxypiperidin-4-yl]oxy-dimethylsilane?
The InChIKey is ZFPRWXMWXGFZIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H39NO2Si2/c1-15(2,3)21(7,8)19-17(11-13-18-14-12-17)20-22(9,10)16(4,5)6/h18H,11-14H2,1-10H3.
What are the key properties of tert-butyl-[4-[tert-butyl(dimethyl)silyl]oxypiperidin-4-yl]oxy-dimethylsilane?
tert-butyl-[4-[tert-butyl(dimethyl)silyl]oxypiperidin-4-yl]oxy-dimethylsilane has a molecular weight of 345.68 g/mol, XLogP of 5.11, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[4-[tert-butyl(dimethyl)silyl]oxypiperidin-4-yl]oxy-dimethylsilane is sourced from PubChem (CID 141193020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).