2-methyl-1-(2-trimethylsilylethynyl)cyclopent-2-en-1-ol

C11H18OSi — CID 172756628

IUPAC2-methyl-1-(2-trimethylsilylethynyl)cyclopent-2-en-1-ol
SMILESCC1=CCCC1(O)C#C[Si](C)(C)C
InChIInChI=1S/C11H18OSi/c1-10-6-5-7-11(10,12)8-9-13(2,3)4/h6,12H,5,7H2,1-4H3
InChIKeyLCOOEIIMVGSAJL-UHFFFAOYSA-N
MW194.35 g/mol
LogP2.34
Rot. Bonds

About 2-methyl-1-(2-trimethylsilylethynyl)cyclopent-2-en-1-ol

2-methyl-1-(2-trimethylsilylethynyl)cyclopent-2-en-1-ol (PubChem CID 172756628) has the molecular formula C11H18OSi and a molecular weight of 194.35 g/mol. Its IUPAC name is 2-methyl-1-(2-trimethylsilylethynyl)cyclopent-2-en-1-ol.

Molecular Properties

Compound Name2-methyl-1-(2-trimethylsilylethynyl)cyclopent-2-en-1-ol
PubChem CID172756628
Molecular FormulaC11H18OSi
Molecular Weight194.35 g/mol
Exact Mass194.11
IUPAC Name2-methyl-1-(2-trimethylsilylethynyl)cyclopent-2-en-1-ol
SMILESCC1=CCCC1(O)C#C[Si](C)(C)C
InChIInChI=1S/C11H18OSi/c1-10-6-5-7-11(10,12)8-9-13(2,3)4/h6,12H,5,7H2,1-4H3
InChIKeyLCOOEIIMVGSAJL-UHFFFAOYSA-N
XLogP2.34
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.35
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-(2-trimethylsilylethynyl)cyclopent-2-en-1-ol?
The IUPAC name of 2-methyl-1-(2-trimethylsilylethynyl)cyclopent-2-en-1-ol (CID 172756628) is 2-methyl-1-(2-trimethylsilylethynyl)cyclopent-2-en-1-ol.
What is the SMILES notation for 2-methyl-1-(2-trimethylsilylethynyl)cyclopent-2-en-1-ol?
The canonical SMILES for 2-methyl-1-(2-trimethylsilylethynyl)cyclopent-2-en-1-ol is CC1=CCCC1(O)C#C[Si](C)(C)C.
What is the InChIKey of 2-methyl-1-(2-trimethylsilylethynyl)cyclopent-2-en-1-ol?
The InChIKey is LCOOEIIMVGSAJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18OSi/c1-10-6-5-7-11(10,12)8-9-13(2,3)4/h6,12H,5,7H2,1-4H3.
What are the key properties of 2-methyl-1-(2-trimethylsilylethynyl)cyclopent-2-en-1-ol?
2-methyl-1-(2-trimethylsilylethynyl)cyclopent-2-en-1-ol has a molecular weight of 194.35 g/mol, XLogP of 2.34, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-(2-trimethylsilylethynyl)cyclopent-2-en-1-ol is sourced from PubChem (CID 172756628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).