trimethyl-(3-methyl-3-phenylbut-1-ynyl)silane

C14H20Si — CID 68608831

IUPACtrimethyl-(3-methyl-3-phenylbut-1-ynyl)silane
SMILESCC(C)(C#C[Si](C)(C)C)c1ccccc1
InChIInChI=1S/C14H20Si/c1-14(2,11-12-15(3,4)5)13-9-7-6-8-10-13/h6-10H,1-5H3
InChIKeyVPMKAMGZKDWFOF-UHFFFAOYSA-N
MW216.40 g/mol
LogP3.85
Rot. Bonds1

About trimethyl-(3-methyl-3-phenylbut-1-ynyl)silane

trimethyl-(3-methyl-3-phenylbut-1-ynyl)silane (PubChem CID 68608831) has the molecular formula C14H20Si and a molecular weight of 216.40 g/mol. Its IUPAC name is trimethyl-(3-methyl-3-phenylbut-1-ynyl)silane.

Molecular Properties

Compound Nametrimethyl-(3-methyl-3-phenylbut-1-ynyl)silane
PubChem CID68608831
Molecular FormulaC14H20Si
Molecular Weight216.40 g/mol
Exact Mass216.13
IUPAC Nametrimethyl-(3-methyl-3-phenylbut-1-ynyl)silane
SMILESCC(C)(C#C[Si](C)(C)C)c1ccccc1
InChIInChI=1S/C14H20Si/c1-14(2,11-12-15(3,4)5)13-9-7-6-8-10-13/h6-10H,1-5H3
InChIKeyVPMKAMGZKDWFOF-UHFFFAOYSA-N
XLogP3.85
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.40
LogP ≤ 53.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze trimethyl-(3-methyl-3-phenylbut-1-ynyl)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-(3-methyl-3-phenylbut-1-ynyl)silane?
The IUPAC name of trimethyl-(3-methyl-3-phenylbut-1-ynyl)silane (CID 68608831) is trimethyl-(3-methyl-3-phenylbut-1-ynyl)silane.
What is the SMILES notation for trimethyl-(3-methyl-3-phenylbut-1-ynyl)silane?
The canonical SMILES for trimethyl-(3-methyl-3-phenylbut-1-ynyl)silane is CC(C)(C#C[Si](C)(C)C)c1ccccc1.
What is the InChIKey of trimethyl-(3-methyl-3-phenylbut-1-ynyl)silane?
The InChIKey is VPMKAMGZKDWFOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20Si/c1-14(2,11-12-15(3,4)5)13-9-7-6-8-10-13/h6-10H,1-5H3.
What are the key properties of trimethyl-(3-methyl-3-phenylbut-1-ynyl)silane?
trimethyl-(3-methyl-3-phenylbut-1-ynyl)silane has a molecular weight of 216.40 g/mol, XLogP of 3.85, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-(3-methyl-3-phenylbut-1-ynyl)silane is sourced from PubChem (CID 68608831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).