triethyl-(5-fluoro-2-triethylsilyloxypyrimidin-4-yl)oxysilane

C16H31FN2O2Si2 — CID 71364147

IUPACtriethyl-(5-fluoro-2-triethylsilyloxypyrimidin-4-yl)oxysilane
SMILESCC[Si](CC)(CC)Oc1ncc(F)c(O[Si](CC)(CC)CC)n1
InChIInChI=1S/C16H31FN2O2Si2/c1-7-22(8-2,9-3)20-15-14(17)13-18-16(19-15)21-23(10-4,11-5)12-6/h13H,7-12H2,1-6H3
InChIKeyWNKAELZQKBDRSR-UHFFFAOYSA-N
MW358.61 g/mol
LogP5.38
Rot. Bonds10

About triethyl-(5-fluoro-2-triethylsilyloxypyrimidin-4-yl)oxysilane

triethyl-(5-fluoro-2-triethylsilyloxypyrimidin-4-yl)oxysilane (PubChem CID 71364147) has the molecular formula C16H31FN2O2Si2 and a molecular weight of 358.61 g/mol. Its IUPAC name is triethyl-(5-fluoro-2-triethylsilyloxypyrimidin-4-yl)oxysilane.

Molecular Properties

Compound Nametriethyl-(5-fluoro-2-triethylsilyloxypyrimidin-4-yl)oxysilane
PubChem CID71364147
Molecular FormulaC16H31FN2O2Si2
Molecular Weight358.61 g/mol
Exact Mass358.19
IUPAC Nametriethyl-(5-fluoro-2-triethylsilyloxypyrimidin-4-yl)oxysilane
SMILESCC[Si](CC)(CC)Oc1ncc(F)c(O[Si](CC)(CC)CC)n1
InChIInChI=1S/C16H31FN2O2Si2/c1-7-22(8-2,9-3)20-15-14(17)13-18-16(19-15)21-23(10-4,11-5)12-6/h13H,7-12H2,1-6H3
InChIKeyWNKAELZQKBDRSR-UHFFFAOYSA-N
XLogP5.38
TPSA44.24 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500358.61
LogP ≤ 55.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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 triethyl-(5-fluoro-2-triethylsilyloxypyrimidin-4-yl)oxysilane?
The IUPAC name of triethyl-(5-fluoro-2-triethylsilyloxypyrimidin-4-yl)oxysilane (CID 71364147) is triethyl-(5-fluoro-2-triethylsilyloxypyrimidin-4-yl)oxysilane.
What is the SMILES notation for triethyl-(5-fluoro-2-triethylsilyloxypyrimidin-4-yl)oxysilane?
The canonical SMILES for triethyl-(5-fluoro-2-triethylsilyloxypyrimidin-4-yl)oxysilane is CC[Si](CC)(CC)Oc1ncc(F)c(O[Si](CC)(CC)CC)n1.
What is the InChIKey of triethyl-(5-fluoro-2-triethylsilyloxypyrimidin-4-yl)oxysilane?
The InChIKey is WNKAELZQKBDRSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31FN2O2Si2/c1-7-22(8-2,9-3)20-15-14(17)13-18-16(19-15)21-23(10-4,11-5)12-6/h13H,7-12H2,1-6H3.
What are the key properties of triethyl-(5-fluoro-2-triethylsilyloxypyrimidin-4-yl)oxysilane?
triethyl-(5-fluoro-2-triethylsilyloxypyrimidin-4-yl)oxysilane has a molecular weight of 358.61 g/mol, XLogP of 5.38, 10 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for triethyl-(5-fluoro-2-triethylsilyloxypyrimidin-4-yl)oxysilane is sourced from PubChem (CID 71364147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).