4-[bis[4-(dimethylamino)phenyl]-hydroxysilyl]-N,N-dimethylaniline

C24H31N3OSi — CID 4097677

IUPAC4-[bis[4-(dimethylamino)phenyl]-hydroxysilyl]-N,N-dimethylaniline
SMILESCN(C)c1ccc([Si](O)(c2ccc(N(C)C)cc2)c2ccc(N(C)C)cc2)cc1
InChIInChI=1S/C24H31N3OSi/c1-25(2)19-7-13-22(14-8-19)29(28,23-15-9-20(10-16-23)26(3)4)24-17-11-21(12-18-24)27(5)6/h7-18,28H,1-6H3
InChIKeyPUDXFEVJPREIGF-UHFFFAOYSA-N
MW405.62 g/mol
LogP1.84
Rot. Bonds6

About 4-[bis[4-(dimethylamino)phenyl]-hydroxysilyl]-N,N-dimethylaniline

4-[bis[4-(dimethylamino)phenyl]-hydroxysilyl]-N,N-dimethylaniline (PubChem CID 4097677) has the molecular formula C24H31N3OSi and a molecular weight of 405.62 g/mol. Its IUPAC name is 4-[bis[4-(dimethylamino)phenyl]-hydroxysilyl]-N,N-dimethylaniline.

Molecular Properties

Compound Name4-[bis[4-(dimethylamino)phenyl]-hydroxysilyl]-N,N-dimethylaniline
PubChem CID4097677
Molecular FormulaC24H31N3OSi
Molecular Weight405.62 g/mol
Exact Mass405.22
IUPAC Name4-[bis[4-(dimethylamino)phenyl]-hydroxysilyl]-N,N-dimethylaniline
SMILESCN(C)c1ccc([Si](O)(c2ccc(N(C)C)cc2)c2ccc(N(C)C)cc2)cc1
InChIInChI=1S/C24H31N3OSi/c1-25(2)19-7-13-22(14-8-19)29(28,23-15-9-20(10-16-23)26(3)4)24-17-11-21(12-18-24)27(5)6/h7-18,28H,1-6H3
InChIKeyPUDXFEVJPREIGF-UHFFFAOYSA-N
XLogP1.84
TPSA29.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500405.62
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 4-[bis[4-(dimethylamino)phenyl]-hydroxysilyl]-N,N-dimethylaniline 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-[bis[4-(dimethylamino)phenyl]-hydroxysilyl]-N,N-dimethylaniline?
The IUPAC name of 4-[bis[4-(dimethylamino)phenyl]-hydroxysilyl]-N,N-dimethylaniline (CID 4097677) is 4-[bis[4-(dimethylamino)phenyl]-hydroxysilyl]-N,N-dimethylaniline.
What is the SMILES notation for 4-[bis[4-(dimethylamino)phenyl]-hydroxysilyl]-N,N-dimethylaniline?
The canonical SMILES for 4-[bis[4-(dimethylamino)phenyl]-hydroxysilyl]-N,N-dimethylaniline is CN(C)c1ccc([Si](O)(c2ccc(N(C)C)cc2)c2ccc(N(C)C)cc2)cc1.
What is the InChIKey of 4-[bis[4-(dimethylamino)phenyl]-hydroxysilyl]-N,N-dimethylaniline?
The InChIKey is PUDXFEVJPREIGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H31N3OSi/c1-25(2)19-7-13-22(14-8-19)29(28,23-15-9-20(10-16-23)26(3)4)24-17-11-21(12-18-24)27(5)6/h7-18,28H,1-6H3.
What are the key properties of 4-[bis[4-(dimethylamino)phenyl]-hydroxysilyl]-N,N-dimethylaniline?
4-[bis[4-(dimethylamino)phenyl]-hydroxysilyl]-N,N-dimethylaniline has a molecular weight of 405.62 g/mol, XLogP of 1.84, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[bis[4-(dimethylamino)phenyl]-hydroxysilyl]-N,N-dimethylaniline is sourced from PubChem (CID 4097677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).