1-cyclohexyl-2-methylpent-4-yn-2-ol;triethyl(triethylsilyloxy)silane

C24H50O2Si2 — CID 88841064

IUPAC1-cyclohexyl-2-methylpent-4-yn-2-ol;triethyl(triethylsilyloxy)silane
SMILESC#CCC(C)(O)CC1CCCCC1.CC[Si](CC)(CC)O[Si](CC)(CC)CC
InChIInChI=1S/C12H30OSi2.C12H20O/c1-7-14(8-2,9-3)13-15(10-4,11-5)12-6;1-3-9-12(2,13)10-11-7-5-4-6-8-11/h7-12H2,1-6H3;1,11,13H,4-10H2,2H3
InChIKeyYXHYMXDGWKDWAJ-UHFFFAOYSA-N
MW426.83 g/mol
LogP7.74
Rot. Bonds11

About 1-cyclohexyl-2-methylpent-4-yn-2-ol;triethyl(triethylsilyloxy)silane

1-cyclohexyl-2-methylpent-4-yn-2-ol;triethyl(triethylsilyloxy)silane (PubChem CID 88841064) has the molecular formula C24H50O2Si2 and a molecular weight of 426.83 g/mol. Its IUPAC name is 1-cyclohexyl-2-methylpent-4-yn-2-ol;triethyl(triethylsilyloxy)silane.

Molecular Properties

Compound Name1-cyclohexyl-2-methylpent-4-yn-2-ol;triethyl(triethylsilyloxy)silane
PubChem CID88841064
Molecular FormulaC24H50O2Si2
Molecular Weight426.83 g/mol
Exact Mass426.33
IUPAC Name1-cyclohexyl-2-methylpent-4-yn-2-ol;triethyl(triethylsilyloxy)silane
SMILESC#CCC(C)(O)CC1CCCCC1.CC[Si](CC)(CC)O[Si](CC)(CC)CC
InChIInChI=1S/C12H30OSi2.C12H20O/c1-7-14(8-2,9-3)13-15(10-4,11-5)12-6;1-3-9-12(2,13)10-11-7-5-4-6-8-11/h7-12H2,1-6H3;1,11,13H,4-10H2,2H3
InChIKeyYXHYMXDGWKDWAJ-UHFFFAOYSA-N
XLogP7.74
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500426.83
LogP ≤ 57.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 1-cyclohexyl-2-methylpent-4-yn-2-ol;triethyl(triethylsilyloxy)silane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-2-methylpent-4-yn-2-ol;triethyl(triethylsilyloxy)silane?
The IUPAC name of 1-cyclohexyl-2-methylpent-4-yn-2-ol;triethyl(triethylsilyloxy)silane (CID 88841064) is 1-cyclohexyl-2-methylpent-4-yn-2-ol;triethyl(triethylsilyloxy)silane.
What is the SMILES notation for 1-cyclohexyl-2-methylpent-4-yn-2-ol;triethyl(triethylsilyloxy)silane?
The canonical SMILES for 1-cyclohexyl-2-methylpent-4-yn-2-ol;triethyl(triethylsilyloxy)silane is C#CCC(C)(O)CC1CCCCC1.CC[Si](CC)(CC)O[Si](CC)(CC)CC.
What is the InChIKey of 1-cyclohexyl-2-methylpent-4-yn-2-ol;triethyl(triethylsilyloxy)silane?
The InChIKey is YXHYMXDGWKDWAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H30OSi2.C12H20O/c1-7-14(8-2,9-3)13-15(10-4,11-5)12-6;1-3-9-12(2,13)10-11-7-5-4-6-8-11/h7-12H2,1-6H3;1,11,13H,4-10H2,2H3.
What are the key properties of 1-cyclohexyl-2-methylpent-4-yn-2-ol;triethyl(triethylsilyloxy)silane?
1-cyclohexyl-2-methylpent-4-yn-2-ol;triethyl(triethylsilyloxy)silane has a molecular weight of 426.83 g/mol, XLogP of 7.74, 11 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-2-methylpent-4-yn-2-ol;triethyl(triethylsilyloxy)silane is sourced from PubChem (CID 88841064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).