tert-butyl-[(4,4-difluoropiperidin-3-yl)methoxy]-dimethylsilane

C12H25F2NOSi — CID 164874047

IUPACtert-butyl-[(4,4-difluoropiperidin-3-yl)methoxy]-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)OCC1CNCCC1(F)F
InChIInChI=1S/C12H25F2NOSi/c1-11(2,3)17(4,5)16-9-10-8-15-7-6-12(10,13)14/h10,15H,6-9H2,1-5H3
InChIKeyZIXZUEFGGKUGIC-UHFFFAOYSA-N
MW265.42 g/mol
LogP3.25
Rot. Bonds3

About tert-butyl-[(4,4-difluoropiperidin-3-yl)methoxy]-dimethylsilane

tert-butyl-[(4,4-difluoropiperidin-3-yl)methoxy]-dimethylsilane (PubChem CID 164874047) has the molecular formula C12H25F2NOSi and a molecular weight of 265.42 g/mol. Its IUPAC name is tert-butyl-[(4,4-difluoropiperidin-3-yl)methoxy]-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[(4,4-difluoropiperidin-3-yl)methoxy]-dimethylsilane
PubChem CID164874047
Molecular FormulaC12H25F2NOSi
Molecular Weight265.42 g/mol
Exact Mass265.17
IUPAC Nametert-butyl-[(4,4-difluoropiperidin-3-yl)methoxy]-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)OCC1CNCCC1(F)F
InChIInChI=1S/C12H25F2NOSi/c1-11(2,3)17(4,5)16-9-10-8-15-7-6-12(10,13)14/h10,15H,6-9H2,1-5H3
InChIKeyZIXZUEFGGKUGIC-UHFFFAOYSA-N
XLogP3.25
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.42
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of tert-butyl-[(4,4-difluoropiperidin-3-yl)methoxy]-dimethylsilane?
The IUPAC name of tert-butyl-[(4,4-difluoropiperidin-3-yl)methoxy]-dimethylsilane (CID 164874047) is tert-butyl-[(4,4-difluoropiperidin-3-yl)methoxy]-dimethylsilane.
What is the SMILES notation for tert-butyl-[(4,4-difluoropiperidin-3-yl)methoxy]-dimethylsilane?
The canonical SMILES for tert-butyl-[(4,4-difluoropiperidin-3-yl)methoxy]-dimethylsilane is CC(C)(C)[Si](C)(C)OCC1CNCCC1(F)F.
What is the InChIKey of tert-butyl-[(4,4-difluoropiperidin-3-yl)methoxy]-dimethylsilane?
The InChIKey is ZIXZUEFGGKUGIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25F2NOSi/c1-11(2,3)17(4,5)16-9-10-8-15-7-6-12(10,13)14/h10,15H,6-9H2,1-5H3.
What are the key properties of tert-butyl-[(4,4-difluoropiperidin-3-yl)methoxy]-dimethylsilane?
tert-butyl-[(4,4-difluoropiperidin-3-yl)methoxy]-dimethylsilane has a molecular weight of 265.42 g/mol, XLogP of 3.25, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[(4,4-difluoropiperidin-3-yl)methoxy]-dimethylsilane is sourced from PubChem (CID 164874047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).