trimethyl-[(2-methylcyclopenta-1,4-dien-1-yl)methyl]silane

C10H18Si — CID 67579559

IUPACtrimethyl-[(2-methylcyclopenta-1,4-dien-1-yl)methyl]silane
SMILESCC1=C(C[Si](C)(C)C)C=CC1
InChIInChI=1S/C10H18Si/c1-9-6-5-7-10(9)8-11(2,3)4/h5,7H,6,8H2,1-4H3
InChIKeyVRJILIWSEAGWNG-UHFFFAOYSA-N
MW166.34 g/mol
LogP3.60
Rot. Bonds2

About trimethyl-[(2-methylcyclopenta-1,4-dien-1-yl)methyl]silane

trimethyl-[(2-methylcyclopenta-1,4-dien-1-yl)methyl]silane (PubChem CID 67579559) has the molecular formula C10H18Si and a molecular weight of 166.34 g/mol. Its IUPAC name is trimethyl-[(2-methylcyclopenta-1,4-dien-1-yl)methyl]silane.

Molecular Properties

Compound Nametrimethyl-[(2-methylcyclopenta-1,4-dien-1-yl)methyl]silane
PubChem CID67579559
Molecular FormulaC10H18Si
Molecular Weight166.34 g/mol
Exact Mass166.12
IUPAC Nametrimethyl-[(2-methylcyclopenta-1,4-dien-1-yl)methyl]silane
SMILESCC1=C(C[Si](C)(C)C)C=CC1
InChIInChI=1S/C10H18Si/c1-9-6-5-7-10(9)8-11(2,3)4/h5,7H,6,8H2,1-4H3
InChIKeyVRJILIWSEAGWNG-UHFFFAOYSA-N
XLogP3.60
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.34
LogP ≤ 53.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze trimethyl-[(2-methylcyclopenta-1,4-dien-1-yl)methyl]silane 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-[(2-methylcyclopenta-1,4-dien-1-yl)methyl]silane?
The IUPAC name of trimethyl-[(2-methylcyclopenta-1,4-dien-1-yl)methyl]silane (CID 67579559) is trimethyl-[(2-methylcyclopenta-1,4-dien-1-yl)methyl]silane.
What is the SMILES notation for trimethyl-[(2-methylcyclopenta-1,4-dien-1-yl)methyl]silane?
The canonical SMILES for trimethyl-[(2-methylcyclopenta-1,4-dien-1-yl)methyl]silane is CC1=C(C[Si](C)(C)C)C=CC1.
What is the InChIKey of trimethyl-[(2-methylcyclopenta-1,4-dien-1-yl)methyl]silane?
The InChIKey is VRJILIWSEAGWNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18Si/c1-9-6-5-7-10(9)8-11(2,3)4/h5,7H,6,8H2,1-4H3.
What are the key properties of trimethyl-[(2-methylcyclopenta-1,4-dien-1-yl)methyl]silane?
trimethyl-[(2-methylcyclopenta-1,4-dien-1-yl)methyl]silane has a molecular weight of 166.34 g/mol, XLogP of 3.60, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[(2-methylcyclopenta-1,4-dien-1-yl)methyl]silane is sourced from PubChem (CID 67579559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).