[(1E)-1-(2-but-3-enylcyclopentylidene)but-3-enyl]-trimethylsilane

C16H28Si — CID 135031511

IUPAC[(1E)-1-(2-but-3-enylcyclopentylidene)but-3-enyl]-trimethylsilane
SMILESC=CCCC1CCC/C1=C(/CC=C)[Si](C)(C)C
InChIInChI=1S/C16H28Si/c1-6-8-11-14-12-9-13-15(14)16(10-7-2)17(3,4)5/h6-7,14H,1-2,8-13H2,3-5H3/b16-15+
InChIKeyJIISQDYUTGCXQM-FOCLMDBBSA-N
MW248.49 g/mol
LogP5.50
Rot. Bonds6

About [(1E)-1-(2-but-3-enylcyclopentylidene)but-3-enyl]-trimethylsilane

[(1E)-1-(2-but-3-enylcyclopentylidene)but-3-enyl]-trimethylsilane (PubChem CID 135031511) has the molecular formula C16H28Si and a molecular weight of 248.49 g/mol. Its IUPAC name is [(1E)-1-(2-but-3-enylcyclopentylidene)but-3-enyl]-trimethylsilane.

Molecular Properties

Compound Name[(1E)-1-(2-but-3-enylcyclopentylidene)but-3-enyl]-trimethylsilane
PubChem CID135031511
Molecular FormulaC16H28Si
Molecular Weight248.49 g/mol
Exact Mass248.20
IUPAC Name[(1E)-1-(2-but-3-enylcyclopentylidene)but-3-enyl]-trimethylsilane
SMILESC=CCCC1CCC/C1=C(/CC=C)[Si](C)(C)C
InChIInChI=1S/C16H28Si/c1-6-8-11-14-12-9-13-15(14)16(10-7-2)17(3,4)5/h6-7,14H,1-2,8-13H2,3-5H3/b16-15+
InChIKeyJIISQDYUTGCXQM-FOCLMDBBSA-N
XLogP5.50
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500248.49
LogP ≤ 55.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze [(1E)-1-(2-but-3-enylcyclopentylidene)but-3-enyl]-trimethylsilane 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

1-Ethenyl-3 (1-hexenyl)-4-trimethylsilyl cyclopentane
CID 551987
[(6E)-8-cyclohexylocta-1,6-dien-3-yl]-triethylsilane
CID 11460962
[(E)-4-cyclohexylbut-2-enyl]-trimethylsilane
CID 11820449
1-Trimethylsilylmethyl-4-methylcyclohexene
CID 23264754
trimethyl-[2-[[(1R,5S)-2-methyl-5-prop-1-en-2-ylcyclohex-2-en-1-yl]methyl]cyclopropen-1-yl]silane
CID 71489379
[2-(2,6-Dimethylhept-5-enyl)cyclopropen-1-yl]-trimethylsilane
CID 101516449
3-[(1S)-cyclohex-2-en-1-yl]propyl-trimethylsilane
CID 134861128
dichloro-[(Z)-1-cyclopentyl-2-methylbut-2-enyl]-methylsilane
CID 134900690
[(E)-2-prop-2-enyloct-1-enyl]cyclopentane
CID 134903308
Trimethyl-[2-(4-methylcyclohex-3-en-1-yl)prop-2-enyl]silane
CID 134978770
[(Z)-2-prop-2-enyloct-1-enyl]cyclopentane
CID 134979170
[(E)-1-cyclopentyl-3-tributylstannylprop-1-en-2-yl]-trimethylsilane
CID 135000971

Frequently Asked Questions

What is the IUPAC name of [(1E)-1-(2-but-3-enylcyclopentylidene)but-3-enyl]-trimethylsilane?
The IUPAC name of [(1E)-1-(2-but-3-enylcyclopentylidene)but-3-enyl]-trimethylsilane (CID 135031511) is [(1E)-1-(2-but-3-enylcyclopentylidene)but-3-enyl]-trimethylsilane.
What is the SMILES notation for [(1E)-1-(2-but-3-enylcyclopentylidene)but-3-enyl]-trimethylsilane?
The canonical SMILES for [(1E)-1-(2-but-3-enylcyclopentylidene)but-3-enyl]-trimethylsilane is C=CCCC1CCC/C1=C(/CC=C)[Si](C)(C)C.
What is the InChIKey of [(1E)-1-(2-but-3-enylcyclopentylidene)but-3-enyl]-trimethylsilane?
The InChIKey is JIISQDYUTGCXQM-FOCLMDBBSA-N. The full InChI is InChI=1S/C16H28Si/c1-6-8-11-14-12-9-13-15(14)16(10-7-2)17(3,4)5/h6-7,14H,1-2,8-13H2,3-5H3/b16-15+.
What are the key properties of [(1E)-1-(2-but-3-enylcyclopentylidene)but-3-enyl]-trimethylsilane?
[(1E)-1-(2-but-3-enylcyclopentylidene)but-3-enyl]-trimethylsilane has a molecular weight of 248.49 g/mol, XLogP of 5.50, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(1E)-1-(2-but-3-enylcyclopentylidene)but-3-enyl]-trimethylsilane is sourced from PubChem (CID 135031511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).