cyclopenta-1,4-dien-1-yl-(cyclopenta-1,4-dien-1-ylmethyl)-diphenylsilane

C23H22Si — CID 87448716

IUPACcyclopenta-1,4-dien-1-yl-(cyclopenta-1,4-dien-1-ylmethyl)-diphenylsilane
SMILESC1=CC(C[Si](C2=CCC=C2)(c2ccccc2)c2ccccc2)=CC1
InChIInChI=1S/C23H22Si/c1-3-13-21(14-4-1)24(23-17-9-10-18-23,19-20-11-7-8-12-20)22-15-5-2-6-16-22/h1-7,9,11-18H,8,10,19H2
InChIKeyCZAUWRHXCDMHFI-UHFFFAOYSA-N
MW326.51 g/mol
LogP4.56
Rot. Bonds5

About cyclopenta-1,4-dien-1-yl-(cyclopenta-1,4-dien-1-ylmethyl)-diphenylsilane

cyclopenta-1,4-dien-1-yl-(cyclopenta-1,4-dien-1-ylmethyl)-diphenylsilane (PubChem CID 87448716) has the molecular formula C23H22Si and a molecular weight of 326.51 g/mol. Its IUPAC name is cyclopenta-1,4-dien-1-yl-(cyclopenta-1,4-dien-1-ylmethyl)-diphenylsilane.

Molecular Properties

Compound Namecyclopenta-1,4-dien-1-yl-(cyclopenta-1,4-dien-1-ylmethyl)-diphenylsilane
PubChem CID87448716
Molecular FormulaC23H22Si
Molecular Weight326.51 g/mol
Exact Mass326.15
IUPAC Namecyclopenta-1,4-dien-1-yl-(cyclopenta-1,4-dien-1-ylmethyl)-diphenylsilane
SMILESC1=CC(C[Si](C2=CCC=C2)(c2ccccc2)c2ccccc2)=CC1
InChIInChI=1S/C23H22Si/c1-3-13-21(14-4-1)24(23-17-9-10-18-23,19-20-11-7-8-12-20)22-15-5-2-6-16-22/h1-7,9,11-18H,8,10,19H2
InChIKeyCZAUWRHXCDMHFI-UHFFFAOYSA-N
XLogP4.56
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.51
LogP ≤ 54.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze cyclopenta-1,4-dien-1-yl-(cyclopenta-1,4-dien-1-ylmethyl)-diphenylsilane 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 cyclopenta-1,4-dien-1-yl-(cyclopenta-1,4-dien-1-ylmethyl)-diphenylsilane?
The IUPAC name of cyclopenta-1,4-dien-1-yl-(cyclopenta-1,4-dien-1-ylmethyl)-diphenylsilane (CID 87448716) is cyclopenta-1,4-dien-1-yl-(cyclopenta-1,4-dien-1-ylmethyl)-diphenylsilane.
What is the SMILES notation for cyclopenta-1,4-dien-1-yl-(cyclopenta-1,4-dien-1-ylmethyl)-diphenylsilane?
The canonical SMILES for cyclopenta-1,4-dien-1-yl-(cyclopenta-1,4-dien-1-ylmethyl)-diphenylsilane is C1=CC(C[Si](C2=CCC=C2)(c2ccccc2)c2ccccc2)=CC1.
What is the InChIKey of cyclopenta-1,4-dien-1-yl-(cyclopenta-1,4-dien-1-ylmethyl)-diphenylsilane?
The InChIKey is CZAUWRHXCDMHFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22Si/c1-3-13-21(14-4-1)24(23-17-9-10-18-23,19-20-11-7-8-12-20)22-15-5-2-6-16-22/h1-7,9,11-18H,8,10,19H2.
What are the key properties of cyclopenta-1,4-dien-1-yl-(cyclopenta-1,4-dien-1-ylmethyl)-diphenylsilane?
cyclopenta-1,4-dien-1-yl-(cyclopenta-1,4-dien-1-ylmethyl)-diphenylsilane has a molecular weight of 326.51 g/mol, XLogP of 4.56, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopenta-1,4-dien-1-yl-(cyclopenta-1,4-dien-1-ylmethyl)-diphenylsilane is sourced from PubChem (CID 87448716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).