5-(3-methoxyphenyl)pent-4-en-1-ynyl-trimethylsilane

C15H20OSi — CID 68705662

IUPAC5-(3-methoxyphenyl)pent-4-en-1-ynyl-trimethylsilane
SMILESCOc1cccc(C=CCC#C[Si](C)(C)C)c1
InChIInChI=1S/C15H20OSi/c1-16-15-11-8-10-14(13-15)9-6-5-7-12-17(2,3)4/h6,8-11,13H,5H2,1-4H3
InChIKeyXNQNWOYKWKPWNI-UHFFFAOYSA-N
MW244.41 g/mol
LogP3.98
Rot. Bonds3

About 5-(3-methoxyphenyl)pent-4-en-1-ynyl-trimethylsilane

5-(3-methoxyphenyl)pent-4-en-1-ynyl-trimethylsilane (PubChem CID 68705662) has the molecular formula C15H20OSi and a molecular weight of 244.41 g/mol. Its IUPAC name is 5-(3-methoxyphenyl)pent-4-en-1-ynyl-trimethylsilane.

Molecular Properties

Compound Name5-(3-methoxyphenyl)pent-4-en-1-ynyl-trimethylsilane
PubChem CID68705662
Molecular FormulaC15H20OSi
Molecular Weight244.41 g/mol
Exact Mass244.13
IUPAC Name5-(3-methoxyphenyl)pent-4-en-1-ynyl-trimethylsilane
SMILESCOc1cccc(C=CCC#C[Si](C)(C)C)c1
InChIInChI=1S/C15H20OSi/c1-16-15-11-8-10-14(13-15)9-6-5-7-12-17(2,3)4/h6,8-11,13H,5H2,1-4H3
InChIKeyXNQNWOYKWKPWNI-UHFFFAOYSA-N
XLogP3.98
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.41
LogP ≤ 53.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

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CID 5382989
[(E)-3-(3-methoxyphenyl)prop-2-enyl] formate
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CID 11401879
(E)-6-(3-methoxyphenyl)hex-5-en-3-one
CID 71490780
(E)-6-(3-methoxyphenyl)hex-5-en-1-ol
CID 14739737
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CID 170479718
2-[(Z)-3-(3-methoxyphenyl)prop-2-enyl]-1,3-dioxane
CID 117062487
N-(2-methoxyethyl)-3-(3-methoxyphenyl)prop-2-en-1-amine
CID 79340458
4-[(Z)-2-(3-methoxyphenyl)ethenyl]-2-[4-[(Z)-2-(3-methoxyphenyl)ethenyl]-2-pyridinyl]pyridine
CID 97104200
(3-methoxyphenyl)methylidene-dimethylazanium iodide
CID 13184830
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2-[1-[4-(3-methoxyphenyl)but-3-enylsulfanyl]ethyl]-5-methyl-1,3,4-oxadiazole
CID 127266515

Frequently Asked Questions

What is the IUPAC name of 5-(3-methoxyphenyl)pent-4-en-1-ynyl-trimethylsilane?
The IUPAC name of 5-(3-methoxyphenyl)pent-4-en-1-ynyl-trimethylsilane (CID 68705662) is 5-(3-methoxyphenyl)pent-4-en-1-ynyl-trimethylsilane.
What is the SMILES notation for 5-(3-methoxyphenyl)pent-4-en-1-ynyl-trimethylsilane?
The canonical SMILES for 5-(3-methoxyphenyl)pent-4-en-1-ynyl-trimethylsilane is COc1cccc(C=CCC#C[Si](C)(C)C)c1.
What is the InChIKey of 5-(3-methoxyphenyl)pent-4-en-1-ynyl-trimethylsilane?
The InChIKey is XNQNWOYKWKPWNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20OSi/c1-16-15-11-8-10-14(13-15)9-6-5-7-12-17(2,3)4/h6,8-11,13H,5H2,1-4H3.
What are the key properties of 5-(3-methoxyphenyl)pent-4-en-1-ynyl-trimethylsilane?
5-(3-methoxyphenyl)pent-4-en-1-ynyl-trimethylsilane has a molecular weight of 244.41 g/mol, XLogP of 3.98, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-methoxyphenyl)pent-4-en-1-ynyl-trimethylsilane is sourced from PubChem (CID 68705662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).