trimethyl-[3-[(1Z,3E)-5-(oxan-2-yloxy)penta-1,3-dienyl]cyclohexen-1-yl]oxysilane

C19H32O3Si — CID 101033659

IUPACtrimethyl-[3-[(1Z,3E)-5-(oxan-2-yloxy)penta-1,3-dienyl]cyclohexen-1-yl]oxysilane
SMILESC[Si](C)(C)OC1=CC(/C=C\C=C\COC2CCCCO2)CCC1
InChIInChI=1S/C19H32O3Si/c1-23(2,3)22-18-12-9-11-17(16-18)10-5-4-7-14-20-19-13-6-8-15-21-19/h4-5,7,10,16-17,19H,6,8-9,11-15H2,1-3H3/b7-4+,10-5-
InChIKeyWRSMIEZGCFKQMZ-YFQKQBTRSA-N
MW336.55 g/mol
LogP5.18
Rot. Bonds7

About trimethyl-[3-[(1Z,3E)-5-(oxan-2-yloxy)penta-1,3-dienyl]cyclohexen-1-yl]oxysilane

trimethyl-[3-[(1Z,3E)-5-(oxan-2-yloxy)penta-1,3-dienyl]cyclohexen-1-yl]oxysilane (PubChem CID 101033659) has the molecular formula C19H32O3Si and a molecular weight of 336.55 g/mol. Its IUPAC name is trimethyl-[3-[(1Z,3E)-5-(oxan-2-yloxy)penta-1,3-dienyl]cyclohexen-1-yl]oxysilane.

Molecular Properties

Compound Nametrimethyl-[3-[(1Z,3E)-5-(oxan-2-yloxy)penta-1,3-dienyl]cyclohexen-1-yl]oxysilane
PubChem CID101033659
Molecular FormulaC19H32O3Si
Molecular Weight336.55 g/mol
Exact Mass336.21
IUPAC Nametrimethyl-[3-[(1Z,3E)-5-(oxan-2-yloxy)penta-1,3-dienyl]cyclohexen-1-yl]oxysilane
SMILESC[Si](C)(C)OC1=CC(/C=C\C=C\COC2CCCCO2)CCC1
InChIInChI=1S/C19H32O3Si/c1-23(2,3)22-18-12-9-11-17(16-18)10-5-4-7-14-20-19-13-6-8-15-21-19/h4-5,7,10,16-17,19H,6,8-9,11-15H2,1-3H3/b7-4+,10-5-
InChIKeyWRSMIEZGCFKQMZ-YFQKQBTRSA-N
XLogP5.18
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500336.55
LogP ≤ 55.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze trimethyl-[3-[(1Z,3E)-5-(oxan-2-yloxy)penta-1,3-dienyl]cyclohexen-1-yl]oxysilane 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 trimethyl-[3-[(1Z,3E)-5-(oxan-2-yloxy)penta-1,3-dienyl]cyclohexen-1-yl]oxysilane?
The IUPAC name of trimethyl-[3-[(1Z,3E)-5-(oxan-2-yloxy)penta-1,3-dienyl]cyclohexen-1-yl]oxysilane (CID 101033659) is trimethyl-[3-[(1Z,3E)-5-(oxan-2-yloxy)penta-1,3-dienyl]cyclohexen-1-yl]oxysilane.
What is the SMILES notation for trimethyl-[3-[(1Z,3E)-5-(oxan-2-yloxy)penta-1,3-dienyl]cyclohexen-1-yl]oxysilane?
The canonical SMILES for trimethyl-[3-[(1Z,3E)-5-(oxan-2-yloxy)penta-1,3-dienyl]cyclohexen-1-yl]oxysilane is C[Si](C)(C)OC1=CC(/C=C\C=C\COC2CCCCO2)CCC1.
What is the InChIKey of trimethyl-[3-[(1Z,3E)-5-(oxan-2-yloxy)penta-1,3-dienyl]cyclohexen-1-yl]oxysilane?
The InChIKey is WRSMIEZGCFKQMZ-YFQKQBTRSA-N. The full InChI is InChI=1S/C19H32O3Si/c1-23(2,3)22-18-12-9-11-17(16-18)10-5-4-7-14-20-19-13-6-8-15-21-19/h4-5,7,10,16-17,19H,6,8-9,11-15H2,1-3H3/b7-4+,10-5-.
What are the key properties of trimethyl-[3-[(1Z,3E)-5-(oxan-2-yloxy)penta-1,3-dienyl]cyclohexen-1-yl]oxysilane?
trimethyl-[3-[(1Z,3E)-5-(oxan-2-yloxy)penta-1,3-dienyl]cyclohexen-1-yl]oxysilane has a molecular weight of 336.55 g/mol, XLogP of 5.18, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[3-[(1Z,3E)-5-(oxan-2-yloxy)penta-1,3-dienyl]cyclohexen-1-yl]oxysilane is sourced from PubChem (CID 101033659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).