di(cyclopenta-2,4-dien-1-yl)-dimethoxysilane

C12H16O2Si — CID 11127819

IUPACdi(cyclopenta-2,4-dien-1-yl)-dimethoxysilane
SMILESCO[Si](OC)(C1C=CC=C1)C1C=CC=C1
InChIInChI=1S/C12H16O2Si/c1-13-15(14-2,11-7-3-4-8-11)12-9-5-6-10-12/h3-12H,1-2H3
InChIKeyYZDFSKMSVNGTNQ-UHFFFAOYSA-N
MW220.34 g/mol
LogP2.71
Rot. Bonds4

About di(cyclopenta-2,4-dien-1-yl)-dimethoxysilane

di(cyclopenta-2,4-dien-1-yl)-dimethoxysilane (PubChem CID 11127819) has the molecular formula C12H16O2Si and a molecular weight of 220.34 g/mol. Its IUPAC name is di(cyclopenta-2,4-dien-1-yl)-dimethoxysilane.

Molecular Properties

Compound Namedi(cyclopenta-2,4-dien-1-yl)-dimethoxysilane
PubChem CID11127819
Molecular FormulaC12H16O2Si
Molecular Weight220.34 g/mol
Exact Mass220.09
IUPAC Namedi(cyclopenta-2,4-dien-1-yl)-dimethoxysilane
SMILESCO[Si](OC)(C1C=CC=C1)C1C=CC=C1
InChIInChI=1S/C12H16O2Si/c1-13-15(14-2,11-7-3-4-8-11)12-9-5-6-10-12/h3-12H,1-2H3
InChIKeyYZDFSKMSVNGTNQ-UHFFFAOYSA-N
XLogP2.71
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.34
LogP ≤ 52.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze di(cyclopenta-2,4-dien-1-yl)-dimethoxysilane 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 di(cyclopenta-2,4-dien-1-yl)-dimethoxysilane?
The IUPAC name of di(cyclopenta-2,4-dien-1-yl)-dimethoxysilane (CID 11127819) is di(cyclopenta-2,4-dien-1-yl)-dimethoxysilane.
What is the SMILES notation for di(cyclopenta-2,4-dien-1-yl)-dimethoxysilane?
The canonical SMILES for di(cyclopenta-2,4-dien-1-yl)-dimethoxysilane is CO[Si](OC)(C1C=CC=C1)C1C=CC=C1.
What is the InChIKey of di(cyclopenta-2,4-dien-1-yl)-dimethoxysilane?
The InChIKey is YZDFSKMSVNGTNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16O2Si/c1-13-15(14-2,11-7-3-4-8-11)12-9-5-6-10-12/h3-12H,1-2H3.
What are the key properties of di(cyclopenta-2,4-dien-1-yl)-dimethoxysilane?
di(cyclopenta-2,4-dien-1-yl)-dimethoxysilane has a molecular weight of 220.34 g/mol, XLogP of 2.71, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for di(cyclopenta-2,4-dien-1-yl)-dimethoxysilane is sourced from PubChem (CID 11127819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).