tert-butyl-(3-cyclohexylidenepenta-1,4-diynyl)-dimethylsilane

C17H26Si — CID 11708690

IUPACtert-butyl-(3-cyclohexylidenepenta-1,4-diynyl)-dimethylsilane
SMILESC#CC(C#C[Si](C)(C)C(C)(C)C)=C1CCCCC1
InChIInChI=1S/C17H26Si/c1-7-15(16-11-9-8-10-12-16)13-14-18(5,6)17(2,3)4/h1H,8-12H2,2-6H3
InChIKeyWAMIZYZDIHRBNY-UHFFFAOYSA-N
MW258.48 g/mol
LogP4.93
Rot. Bonds

About tert-butyl-(3-cyclohexylidenepenta-1,4-diynyl)-dimethylsilane

tert-butyl-(3-cyclohexylidenepenta-1,4-diynyl)-dimethylsilane (PubChem CID 11708690) has the molecular formula C17H26Si and a molecular weight of 258.48 g/mol. Its IUPAC name is tert-butyl-(3-cyclohexylidenepenta-1,4-diynyl)-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-(3-cyclohexylidenepenta-1,4-diynyl)-dimethylsilane
PubChem CID11708690
Molecular FormulaC17H26Si
Molecular Weight258.48 g/mol
Exact Mass258.18
IUPAC Nametert-butyl-(3-cyclohexylidenepenta-1,4-diynyl)-dimethylsilane
SMILESC#CC(C#C[Si](C)(C)C(C)(C)C)=C1CCCCC1
InChIInChI=1S/C17H26Si/c1-7-15(16-11-9-8-10-12-16)13-14-18(5,6)17(2,3)4/h1H,8-12H2,2-6H3
InChIKeyWAMIZYZDIHRBNY-UHFFFAOYSA-N
XLogP4.93
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.48
LogP ≤ 54.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze tert-butyl-(3-cyclohexylidenepenta-1,4-diynyl)-dimethylsilane with MolForge

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

Launch Full Analysis

Related Compounds

[3-[4-[1,5-Bis(trimethylsilyl)penta-1,4-diyn-3-ylidene]cyclohexylidene]-5-trimethylsilylpenta-1,4-diynyl]-trimethylsilane
CID 15363827
2-Cyclohexylidenepropyl(trimethyl)silane
CID 14433570
Trimethyl-(2-prop-1-ynylcyclopenten-1-yl)silane
CID 91164749
[6,12-Di(cyclohexylidene)-16-methyl-3,9-di(propan-2-ylidene)-15-(2-trimethylsilylethynyl)heptadec-15-en-1,4,7,10,13-pentaynyl]-trimethylsilane
CID 134901393
Triethyl-[6-(2-trimethylsilylcyclopropen-1-yl)hexa-1,3-diynyl]silane
CID 134997996
[3,9-Di(cyclohexylidene)-6-propan-2-ylidene-11-trimethylsilylundeca-1,4,7,10-tetraynyl]-trimethylsilane
CID 135046217
(3-Cyclohexylidene-3-fluoroprop-1-ynyl)-tri(propan-2-yl)silane
CID 10589926
[(Z)-3-butyl-4-ethyldec-3-en-1,5-diynyl]-trimethylsilane
CID 10017015
(3-Cyclohexylidene-5-trimethylsilylpenta-1,4-diynyl)-trimethylsilane
CID 10684806
[3-[4-[1,5-Bis[tri(propan-2-yl)silyl]penta-1,4-diyn-3-ylidene]cyclohexylidene]-5-tri(propan-2-yl)silylpenta-1,4-diynyl]-tri(propan-2-yl)silane
CID 15363828
2-(2-Ethynylcyclohexen-1-yl)ethynyl-tri(propan-2-yl)silane
CID 25139239
[3,8-Di(cyclohexylidene)-10-tri(propan-2-yl)silyldeca-1,4,6,9-tetraynyl]-tri(propan-2-yl)silane
CID 101194213

Frequently Asked Questions

What is the IUPAC name of tert-butyl-(3-cyclohexylidenepenta-1,4-diynyl)-dimethylsilane?
The IUPAC name of tert-butyl-(3-cyclohexylidenepenta-1,4-diynyl)-dimethylsilane (CID 11708690) is tert-butyl-(3-cyclohexylidenepenta-1,4-diynyl)-dimethylsilane.
What is the SMILES notation for tert-butyl-(3-cyclohexylidenepenta-1,4-diynyl)-dimethylsilane?
The canonical SMILES for tert-butyl-(3-cyclohexylidenepenta-1,4-diynyl)-dimethylsilane is C#CC(C#C[Si](C)(C)C(C)(C)C)=C1CCCCC1.
What is the InChIKey of tert-butyl-(3-cyclohexylidenepenta-1,4-diynyl)-dimethylsilane?
The InChIKey is WAMIZYZDIHRBNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26Si/c1-7-15(16-11-9-8-10-12-16)13-14-18(5,6)17(2,3)4/h1H,8-12H2,2-6H3.
What are the key properties of tert-butyl-(3-cyclohexylidenepenta-1,4-diynyl)-dimethylsilane?
tert-butyl-(3-cyclohexylidenepenta-1,4-diynyl)-dimethylsilane has a molecular weight of 258.48 g/mol, XLogP of 4.93, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-(3-cyclohexylidenepenta-1,4-diynyl)-dimethylsilane is sourced from PubChem (CID 11708690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).