triethyl-(2,2,2-trifluoro-1-pyridin-4-ylethoxy)silane

C13H20F3NOSi — CID 59570294

IUPACtriethyl-(2,2,2-trifluoro-1-pyridin-4-ylethoxy)silane
SMILESCC[Si](CC)(CC)OC(c1ccncc1)C(F)(F)F
InChIInChI=1S/C13H20F3NOSi/c1-4-19(5-2,6-3)18-12(13(14,15)16)11-7-9-17-10-8-11/h7-10,12H,4-6H2,1-3H3
InChIKeyIQDMZXAYEMMZAH-UHFFFAOYSA-N
MW291.39 g/mol
LogP4.71
Rot. Bonds6

About triethyl-(2,2,2-trifluoro-1-pyridin-4-ylethoxy)silane

triethyl-(2,2,2-trifluoro-1-pyridin-4-ylethoxy)silane (PubChem CID 59570294) has the molecular formula C13H20F3NOSi and a molecular weight of 291.39 g/mol. Its IUPAC name is triethyl-(2,2,2-trifluoro-1-pyridin-4-ylethoxy)silane.

Molecular Properties

Compound Nametriethyl-(2,2,2-trifluoro-1-pyridin-4-ylethoxy)silane
PubChem CID59570294
Molecular FormulaC13H20F3NOSi
Molecular Weight291.39 g/mol
Exact Mass291.13
IUPAC Nametriethyl-(2,2,2-trifluoro-1-pyridin-4-ylethoxy)silane
SMILESCC[Si](CC)(CC)OC(c1ccncc1)C(F)(F)F
InChIInChI=1S/C13H20F3NOSi/c1-4-19(5-2,6-3)18-12(13(14,15)16)11-7-9-17-10-8-11/h7-10,12H,4-6H2,1-3H3
InChIKeyIQDMZXAYEMMZAH-UHFFFAOYSA-N
XLogP4.71
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.39
LogP ≤ 54.71
H-Bond Donors ≤ 50
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 triethyl-(2,2,2-trifluoro-1-pyridin-4-ylethoxy)silane?
The IUPAC name of triethyl-(2,2,2-trifluoro-1-pyridin-4-ylethoxy)silane (CID 59570294) is triethyl-(2,2,2-trifluoro-1-pyridin-4-ylethoxy)silane.
What is the SMILES notation for triethyl-(2,2,2-trifluoro-1-pyridin-4-ylethoxy)silane?
The canonical SMILES for triethyl-(2,2,2-trifluoro-1-pyridin-4-ylethoxy)silane is CC[Si](CC)(CC)OC(c1ccncc1)C(F)(F)F.
What is the InChIKey of triethyl-(2,2,2-trifluoro-1-pyridin-4-ylethoxy)silane?
The InChIKey is IQDMZXAYEMMZAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20F3NOSi/c1-4-19(5-2,6-3)18-12(13(14,15)16)11-7-9-17-10-8-11/h7-10,12H,4-6H2,1-3H3.
What are the key properties of triethyl-(2,2,2-trifluoro-1-pyridin-4-ylethoxy)silane?
triethyl-(2,2,2-trifluoro-1-pyridin-4-ylethoxy)silane has a molecular weight of 291.39 g/mol, XLogP of 4.71, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for triethyl-(2,2,2-trifluoro-1-pyridin-4-ylethoxy)silane is sourced from PubChem (CID 59570294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).