[(Z)-5-[dimethyl(phenyl)silyl]-1-(4-fluorophenyl)pent-3-enoxy]-triethylsilane

C25H37FOSi2 — CID 154721395

IUPAC[(Z)-5-[dimethyl(phenyl)silyl]-1-(4-fluorophenyl)pent-3-enoxy]-triethylsilane
SMILESCC[Si](CC)(CC)OC(C/C=C\C[Si](C)(C)c1ccccc1)c1ccc(F)cc1
InChIInChI=1S/C25H37FOSi2/c1-6-29(7-2,8-3)27-25(22-17-19-23(26)20-18-22)16-12-13-21-28(4,5)24-14-10-9-11-15-24/h9-15,17-20,25H,6-8,16,21H2,1-5H3/b13-12-
InChIKeyXVKOHARVKSPBGQ-SEYXRHQNSA-N
MW428.74 g/mol
LogP7.45
Rot. Bonds11

About [(Z)-5-[dimethyl(phenyl)silyl]-1-(4-fluorophenyl)pent-3-enoxy]-triethylsilane

[(Z)-5-[dimethyl(phenyl)silyl]-1-(4-fluorophenyl)pent-3-enoxy]-triethylsilane (PubChem CID 154721395) has the molecular formula C25H37FOSi2 and a molecular weight of 428.74 g/mol. Its IUPAC name is [(Z)-5-[dimethyl(phenyl)silyl]-1-(4-fluorophenyl)pent-3-enoxy]-triethylsilane.

Molecular Properties

Compound Name[(Z)-5-[dimethyl(phenyl)silyl]-1-(4-fluorophenyl)pent-3-enoxy]-triethylsilane
PubChem CID154721395
Molecular FormulaC25H37FOSi2
Molecular Weight428.74 g/mol
Exact Mass428.24
IUPAC Name[(Z)-5-[dimethyl(phenyl)silyl]-1-(4-fluorophenyl)pent-3-enoxy]-triethylsilane
SMILESCC[Si](CC)(CC)OC(C/C=C\C[Si](C)(C)c1ccccc1)c1ccc(F)cc1
InChIInChI=1S/C25H37FOSi2/c1-6-29(7-2,8-3)27-25(22-17-19-23(26)20-18-22)16-12-13-21-28(4,5)24-14-10-9-11-15-24/h9-15,17-20,25H,6-8,16,21H2,1-5H3/b13-12-
InChIKeyXVKOHARVKSPBGQ-SEYXRHQNSA-N
XLogP7.45
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds11
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500428.74
LogP ≤ 57.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [(Z)-5-[dimethyl(phenyl)silyl]-1-(4-fluorophenyl)pent-3-enoxy]-triethylsilane?
The IUPAC name of [(Z)-5-[dimethyl(phenyl)silyl]-1-(4-fluorophenyl)pent-3-enoxy]-triethylsilane (CID 154721395) is [(Z)-5-[dimethyl(phenyl)silyl]-1-(4-fluorophenyl)pent-3-enoxy]-triethylsilane.
What is the SMILES notation for [(Z)-5-[dimethyl(phenyl)silyl]-1-(4-fluorophenyl)pent-3-enoxy]-triethylsilane?
The canonical SMILES for [(Z)-5-[dimethyl(phenyl)silyl]-1-(4-fluorophenyl)pent-3-enoxy]-triethylsilane is CC[Si](CC)(CC)OC(C/C=C\C[Si](C)(C)c1ccccc1)c1ccc(F)cc1.
What is the InChIKey of [(Z)-5-[dimethyl(phenyl)silyl]-1-(4-fluorophenyl)pent-3-enoxy]-triethylsilane?
The InChIKey is XVKOHARVKSPBGQ-SEYXRHQNSA-N. The full InChI is InChI=1S/C25H37FOSi2/c1-6-29(7-2,8-3)27-25(22-17-19-23(26)20-18-22)16-12-13-21-28(4,5)24-14-10-9-11-15-24/h9-15,17-20,25H,6-8,16,21H2,1-5H3/b13-12-.
What are the key properties of [(Z)-5-[dimethyl(phenyl)silyl]-1-(4-fluorophenyl)pent-3-enoxy]-triethylsilane?
[(Z)-5-[dimethyl(phenyl)silyl]-1-(4-fluorophenyl)pent-3-enoxy]-triethylsilane has a molecular weight of 428.74 g/mol, XLogP of 7.45, 11 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(Z)-5-[dimethyl(phenyl)silyl]-1-(4-fluorophenyl)pent-3-enoxy]-triethylsilane is sourced from PubChem (CID 154721395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).