4-(4-triphenylsilylphenyl)aniline

C30H25NSi — CID 140709059

IUPAC4-(4-triphenylsilylphenyl)aniline
SMILESNc1ccc(-c2ccc([Si](c3ccccc3)(c3ccccc3)c3ccccc3)cc2)cc1
InChIInChI=1S/C30H25NSi/c31-26-20-16-24(17-21-26)25-18-22-30(23-19-25)32(27-10-4-1-5-11-27,28-12-6-2-7-13-28)29-14-8-3-9-15-29/h1-23H,31H2
InChIKeyXPFNLRDFRKUZSU-UHFFFAOYSA-N
MW427.62 g/mol
LogP4.31
Rot. Bonds5

About 4-(4-triphenylsilylphenyl)aniline

4-(4-triphenylsilylphenyl)aniline (PubChem CID 140709059) has the molecular formula C30H25NSi and a molecular weight of 427.62 g/mol. Its IUPAC name is 4-(4-triphenylsilylphenyl)aniline.

Molecular Properties

Compound Name4-(4-triphenylsilylphenyl)aniline
PubChem CID140709059
Molecular FormulaC30H25NSi
Molecular Weight427.62 g/mol
Exact Mass427.18
IUPAC Name4-(4-triphenylsilylphenyl)aniline
SMILESNc1ccc(-c2ccc([Si](c3ccccc3)(c3ccccc3)c3ccccc3)cc2)cc1
InChIInChI=1S/C30H25NSi/c31-26-20-16-24(17-21-26)25-18-22-30(23-19-25)32(27-10-4-1-5-11-27,28-12-6-2-7-13-28)29-14-8-3-9-15-29/h1-23H,31H2
InChIKeyXPFNLRDFRKUZSU-UHFFFAOYSA-N
XLogP4.31
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500427.62
LogP ≤ 54.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 4-(4-triphenylsilylphenyl)aniline 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 4-(4-triphenylsilylphenyl)aniline?
The IUPAC name of 4-(4-triphenylsilylphenyl)aniline (CID 140709059) is 4-(4-triphenylsilylphenyl)aniline.
What is the SMILES notation for 4-(4-triphenylsilylphenyl)aniline?
The canonical SMILES for 4-(4-triphenylsilylphenyl)aniline is Nc1ccc(-c2ccc([Si](c3ccccc3)(c3ccccc3)c3ccccc3)cc2)cc1.
What is the InChIKey of 4-(4-triphenylsilylphenyl)aniline?
The InChIKey is XPFNLRDFRKUZSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H25NSi/c31-26-20-16-24(17-21-26)25-18-22-30(23-19-25)32(27-10-4-1-5-11-27,28-12-6-2-7-13-28)29-14-8-3-9-15-29/h1-23H,31H2.
What are the key properties of 4-(4-triphenylsilylphenyl)aniline?
4-(4-triphenylsilylphenyl)aniline has a molecular weight of 427.62 g/mol, XLogP of 4.31, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-triphenylsilylphenyl)aniline is sourced from PubChem (CID 140709059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).