4,4',4''-silanetriyltris(N,N-dimethylaniline)

C24H30N3Si — CID 6330580

IUPAC—
SMILESCN(C)c1ccc([Si](c2ccc(N(C)C)cc2)c2ccc(N(C)C)cc2)cc1
InChIInChI=1S/C24H30N3Si/c1-25(2)19-7-13-22(14-8-19)28(23-15-9-20(10-16-23)26(3)4)24-17-11-21(12-18-24)27(5)6/h7-18H,1-6H3
InChIKeyQGIWDLDOMKDRBU-UHFFFAOYSA-N
MW388.61 g/mol
LogP2.40
Rot. Bonds6

About 4,4',4''-silanetriyltris(N,N-dimethylaniline)

4,4',4''-silanetriyltris(N,N-dimethylaniline) (PubChem CID 6330580) has the molecular formula C24H30N3Si and a molecular weight of 388.61 g/mol.

Molecular Properties

Compound Name4,4',4''-silanetriyltris(N,N-dimethylaniline)
PubChem CID6330580
Molecular FormulaC24H30N3Si
Molecular Weight388.61 g/mol
Exact Mass388.22
IUPAC Name—
SMILESCN(C)c1ccc([Si](c2ccc(N(C)C)cc2)c2ccc(N(C)C)cc2)cc1
InChIInChI=1S/C24H30N3Si/c1-25(2)19-7-13-22(14-8-19)28(23-15-9-20(10-16-23)26(3)4)24-17-11-21(12-18-24)27(5)6/h7-18H,1-6H3
InChIKeyQGIWDLDOMKDRBU-UHFFFAOYSA-N
XLogP2.40
TPSA9.72 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.61
LogP ≤ 52.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4,4',4''-silanetriyltris(N,N-dimethylaniline)?
The IUPAC name of 4,4',4''-silanetriyltris(N,N-dimethylaniline) (CID 6330580) is not available.
What is the SMILES notation for 4,4',4''-silanetriyltris(N,N-dimethylaniline)?
The canonical SMILES for 4,4',4''-silanetriyltris(N,N-dimethylaniline) is CN(C)c1ccc([Si](c2ccc(N(C)C)cc2)c2ccc(N(C)C)cc2)cc1.
What is the InChIKey of 4,4',4''-silanetriyltris(N,N-dimethylaniline)?
The InChIKey is QGIWDLDOMKDRBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H30N3Si/c1-25(2)19-7-13-22(14-8-19)28(23-15-9-20(10-16-23)26(3)4)24-17-11-21(12-18-24)27(5)6/h7-18H,1-6H3.
What are the key properties of 4,4',4''-silanetriyltris(N,N-dimethylaniline)?
4,4',4''-silanetriyltris(N,N-dimethylaniline) has a molecular weight of 388.61 g/mol, XLogP of 2.40, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4,4',4''-silanetriyltris(N,N-dimethylaniline) is sourced from PubChem (CID 6330580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).