[1-(cyclopenten-1-yl)-3-methylhex-1-en-5-yn-3-yl]oxy-trimethylsilane

C15H24OSi — CID 54404208

IUPAC[1-(cyclopenten-1-yl)-3-methylhex-1-en-5-yn-3-yl]oxy-trimethylsilane
SMILESC#CCC(C)(C=CC1=CCCC1)O[Si](C)(C)C
InChIInChI=1S/C15H24OSi/c1-6-12-15(2,16-17(3,4)5)13-11-14-9-7-8-10-14/h1,9,11,13H,7-8,10,12H2,2-5H3
InChIKeyVPMSNUUBRBNFEQ-UHFFFAOYSA-N
MW248.44 g/mol
LogP4.29
Rot. Bonds5

About [1-(cyclopenten-1-yl)-3-methylhex-1-en-5-yn-3-yl]oxy-trimethylsilane

[1-(cyclopenten-1-yl)-3-methylhex-1-en-5-yn-3-yl]oxy-trimethylsilane (PubChem CID 54404208) has the molecular formula C15H24OSi and a molecular weight of 248.44 g/mol. Its IUPAC name is [1-(cyclopenten-1-yl)-3-methylhex-1-en-5-yn-3-yl]oxy-trimethylsilane.

Molecular Properties

Compound Name[1-(cyclopenten-1-yl)-3-methylhex-1-en-5-yn-3-yl]oxy-trimethylsilane
PubChem CID54404208
Molecular FormulaC15H24OSi
Molecular Weight248.44 g/mol
Exact Mass248.16
IUPAC Name[1-(cyclopenten-1-yl)-3-methylhex-1-en-5-yn-3-yl]oxy-trimethylsilane
SMILESC#CCC(C)(C=CC1=CCCC1)O[Si](C)(C)C
InChIInChI=1S/C15H24OSi/c1-6-12-15(2,16-17(3,4)5)13-11-14-9-7-8-10-14/h1,9,11,13H,7-8,10,12H2,2-5H3
InChIKeyVPMSNUUBRBNFEQ-UHFFFAOYSA-N
XLogP4.29
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.44
LogP ≤ 54.29
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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Frequently Asked Questions

What is the IUPAC name of [1-(cyclopenten-1-yl)-3-methylhex-1-en-5-yn-3-yl]oxy-trimethylsilane?
The IUPAC name of [1-(cyclopenten-1-yl)-3-methylhex-1-en-5-yn-3-yl]oxy-trimethylsilane (CID 54404208) is [1-(cyclopenten-1-yl)-3-methylhex-1-en-5-yn-3-yl]oxy-trimethylsilane.
What is the SMILES notation for [1-(cyclopenten-1-yl)-3-methylhex-1-en-5-yn-3-yl]oxy-trimethylsilane?
The canonical SMILES for [1-(cyclopenten-1-yl)-3-methylhex-1-en-5-yn-3-yl]oxy-trimethylsilane is C#CCC(C)(C=CC1=CCCC1)O[Si](C)(C)C.
What is the InChIKey of [1-(cyclopenten-1-yl)-3-methylhex-1-en-5-yn-3-yl]oxy-trimethylsilane?
The InChIKey is VPMSNUUBRBNFEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24OSi/c1-6-12-15(2,16-17(3,4)5)13-11-14-9-7-8-10-14/h1,9,11,13H,7-8,10,12H2,2-5H3.
What are the key properties of [1-(cyclopenten-1-yl)-3-methylhex-1-en-5-yn-3-yl]oxy-trimethylsilane?
[1-(cyclopenten-1-yl)-3-methylhex-1-en-5-yn-3-yl]oxy-trimethylsilane has a molecular weight of 248.44 g/mol, XLogP of 4.29, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(cyclopenten-1-yl)-3-methylhex-1-en-5-yn-3-yl]oxy-trimethylsilane is sourced from PubChem (CID 54404208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).