[(E)-3-methoxyprop-1-enyl]-triphenylsilane

C22H22OSi — CID 102399031

IUPAC[(E)-3-methoxyprop-1-enyl]-triphenylsilane
SMILESCOC/C=C/[Si](c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C22H22OSi/c1-23-18-11-19-24(20-12-5-2-6-13-20,21-14-7-3-8-15-21)22-16-9-4-10-17-22/h2-17,19H,18H2,1H3/b19-11+
InChIKeyFXUXVLBIPPUPLE-YBFXNURJSA-N
MW330.50 g/mol
LogP2.90
Rot. Bonds6

About [(E)-3-methoxyprop-1-enyl]-triphenylsilane

[(E)-3-methoxyprop-1-enyl]-triphenylsilane (PubChem CID 102399031) has the molecular formula C22H22OSi and a molecular weight of 330.50 g/mol. Its IUPAC name is [(E)-3-methoxyprop-1-enyl]-triphenylsilane.

Molecular Properties

Compound Name[(E)-3-methoxyprop-1-enyl]-triphenylsilane
PubChem CID102399031
Molecular FormulaC22H22OSi
Molecular Weight330.50 g/mol
Exact Mass330.14
IUPAC Name[(E)-3-methoxyprop-1-enyl]-triphenylsilane
SMILESCOC/C=C/[Si](c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C22H22OSi/c1-23-18-11-19-24(20-12-5-2-6-13-20,21-14-7-3-8-15-21)22-16-9-4-10-17-22/h2-17,19H,18H2,1H3/b19-11+
InChIKeyFXUXVLBIPPUPLE-YBFXNURJSA-N
XLogP2.90
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.50
LogP ≤ 52.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

Analyze [(E)-3-methoxyprop-1-enyl]-triphenylsilane 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 [(E)-3-methoxyprop-1-enyl]-triphenylsilane?
The IUPAC name of [(E)-3-methoxyprop-1-enyl]-triphenylsilane (CID 102399031) is [(E)-3-methoxyprop-1-enyl]-triphenylsilane.
What is the SMILES notation for [(E)-3-methoxyprop-1-enyl]-triphenylsilane?
The canonical SMILES for [(E)-3-methoxyprop-1-enyl]-triphenylsilane is COC/C=C/[Si](c1ccccc1)(c1ccccc1)c1ccccc1.
What is the InChIKey of [(E)-3-methoxyprop-1-enyl]-triphenylsilane?
The InChIKey is FXUXVLBIPPUPLE-YBFXNURJSA-N. The full InChI is InChI=1S/C22H22OSi/c1-23-18-11-19-24(20-12-5-2-6-13-20,21-14-7-3-8-15-21)22-16-9-4-10-17-22/h2-17,19H,18H2,1H3/b19-11+.
What are the key properties of [(E)-3-methoxyprop-1-enyl]-triphenylsilane?
[(E)-3-methoxyprop-1-enyl]-triphenylsilane has a molecular weight of 330.50 g/mol, XLogP of 2.90, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(E)-3-methoxyprop-1-enyl]-triphenylsilane is sourced from PubChem (CID 102399031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).