4-[1-(4-dimethylsilylphenyl)ethenyl]-N,N-bis(trimethylsilyl)aniline

C22H35NSi3 — CID 175827398

IUPAC4-[1-(4-dimethylsilylphenyl)ethenyl]-N,N-bis(trimethylsilyl)aniline
SMILESC=C(c1ccc(N([Si](C)(C)C)[Si](C)(C)C)cc1)c1ccc([SiH](C)C)cc1
InChIInChI=1S/C22H35NSi3/c1-18(20-12-16-22(17-13-20)24(2)3)19-10-14-21(15-11-19)23(25(4,5)6)26(7,8)9/h10-17,24H,1H2,2-9H3
InChIKeyJPLGXYNZLGTGKI-UHFFFAOYSA-N
MW397.79 g/mol
LogP5.92
Rot. Bonds6

About 4-[1-(4-dimethylsilylphenyl)ethenyl]-N,N-bis(trimethylsilyl)aniline

4-[1-(4-dimethylsilylphenyl)ethenyl]-N,N-bis(trimethylsilyl)aniline (PubChem CID 175827398) has the molecular formula C22H35NSi3 and a molecular weight of 397.79 g/mol. Its IUPAC name is 4-[1-(4-dimethylsilylphenyl)ethenyl]-N,N-bis(trimethylsilyl)aniline.

Molecular Properties

Compound Name4-[1-(4-dimethylsilylphenyl)ethenyl]-N,N-bis(trimethylsilyl)aniline
PubChem CID175827398
Molecular FormulaC22H35NSi3
Molecular Weight397.79 g/mol
Exact Mass397.21
IUPAC Name4-[1-(4-dimethylsilylphenyl)ethenyl]-N,N-bis(trimethylsilyl)aniline
SMILESC=C(c1ccc(N([Si](C)(C)C)[Si](C)(C)C)cc1)c1ccc([SiH](C)C)cc1
InChIInChI=1S/C22H35NSi3/c1-18(20-12-16-22(17-13-20)24(2)3)19-10-14-21(15-11-19)23(25(4,5)6)26(7,8)9/h10-17,24H,1H2,2-9H3
InChIKeyJPLGXYNZLGTGKI-UHFFFAOYSA-N
XLogP5.92
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms26
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500397.79
LogP ≤ 55.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4-[1-(4-dimethylsilylphenyl)ethenyl]-N,N-bis(trimethylsilyl)aniline?
The IUPAC name of 4-[1-(4-dimethylsilylphenyl)ethenyl]-N,N-bis(trimethylsilyl)aniline (CID 175827398) is 4-[1-(4-dimethylsilylphenyl)ethenyl]-N,N-bis(trimethylsilyl)aniline.
What is the SMILES notation for 4-[1-(4-dimethylsilylphenyl)ethenyl]-N,N-bis(trimethylsilyl)aniline?
The canonical SMILES for 4-[1-(4-dimethylsilylphenyl)ethenyl]-N,N-bis(trimethylsilyl)aniline is C=C(c1ccc(N([Si](C)(C)C)[Si](C)(C)C)cc1)c1ccc([SiH](C)C)cc1.
What is the InChIKey of 4-[1-(4-dimethylsilylphenyl)ethenyl]-N,N-bis(trimethylsilyl)aniline?
The InChIKey is JPLGXYNZLGTGKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H35NSi3/c1-18(20-12-16-22(17-13-20)24(2)3)19-10-14-21(15-11-19)23(25(4,5)6)26(7,8)9/h10-17,24H,1H2,2-9H3.
What are the key properties of 4-[1-(4-dimethylsilylphenyl)ethenyl]-N,N-bis(trimethylsilyl)aniline?
4-[1-(4-dimethylsilylphenyl)ethenyl]-N,N-bis(trimethylsilyl)aniline has a molecular weight of 397.79 g/mol, XLogP of 5.92, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-(4-dimethylsilylphenyl)ethenyl]-N,N-bis(trimethylsilyl)aniline is sourced from PubChem (CID 175827398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).