4-[dichloro(ethyl)silyl]-N,N-diphenylaniline

C20H19Cl2NSi — CID 23434748

IUPAC4-[dichloro(ethyl)silyl]-N,N-diphenylaniline
SMILESCC[Si](Cl)(Cl)c1ccc(N(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C20H19Cl2NSi/c1-2-24(21,22)20-15-13-19(14-16-20)23(17-9-5-3-6-10-17)18-11-7-4-8-12-18/h3-16H,2H2,1H3
InChIKeyHJFGKOQUGXVWQI-UHFFFAOYSA-N
MW372.37 g/mol
LogP6.30
Rot. Bonds5

About 4-[dichloro(ethyl)silyl]-N,N-diphenylaniline

4-[dichloro(ethyl)silyl]-N,N-diphenylaniline (PubChem CID 23434748) has the molecular formula C20H19Cl2NSi and a molecular weight of 372.37 g/mol. Its IUPAC name is 4-[dichloro(ethyl)silyl]-N,N-diphenylaniline.

Molecular Properties

Compound Name4-[dichloro(ethyl)silyl]-N,N-diphenylaniline
PubChem CID23434748
Molecular FormulaC20H19Cl2NSi
Molecular Weight372.37 g/mol
Exact Mass371.07
IUPAC Name4-[dichloro(ethyl)silyl]-N,N-diphenylaniline
SMILESCC[Si](Cl)(Cl)c1ccc(N(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C20H19Cl2NSi/c1-2-24(21,22)20-15-13-19(14-16-20)23(17-9-5-3-6-10-17)18-11-7-4-8-12-18/h3-16H,2H2,1H3
InChIKeyHJFGKOQUGXVWQI-UHFFFAOYSA-N
XLogP6.30
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500372.37
LogP ≤ 56.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

ethane;1-N,1-N,4-N,4-N-tetraphenylbenzene-1,4-diamine
CID 91310242
N,N-diphenyl-4-[4-[4-(N-(4-trimethylsilylphenyl)anilino)phenyl]phenyl]aniline;N,4-diphenyl-N-[4-[4-[4-(N-(4-trimethylsilylphenyl)anilino)phenyl]phenyl]phenyl]aniline;4-phenyl-N-[4-[4-[4-(N-phenylanilino)phenyl]phenyl]phenyl]-N-(4-trimethylsilylphenyl)aniline
CID 165073252
N,N-diphenylaniline;silane
CID 131739129
N,N-diphenyl-4-[4-[4-(N-phenylanilino)phenyl]phenyl]aniline;ethane
CID 143515973
N,N-diphenyl-4-[4-[4-[4-(N-phenylanilino)phenyl]-N-[4-[4-[4-[4-(N-phenylanilino)phenyl]-N-[4-[4-(N-phenylanilino)phenyl]phenyl]anilino]phenyl]phenyl]anilino]phenyl]aniline
CID 19708505
1-N,1-N,4-N-triphenyl-4-N-[4-[4-(N-[4-(N-phenylanilino)phenyl]anilino)phenyl]phenyl]benzene-1,4-diamine;1-N,1-N,4-N-triphenyl-4-N-[4-[4-(N-[4-[4-(N-phenylanilino)phenyl]phenyl]anilino)phenyl]phenyl]benzene-1,4-diamine;1-N,1-N,4-N-triphenyl-4-N-[4-[4-[4-(N-[4-[4-(N-phenylanilino)phenyl]phenyl]anilino)phenyl]phenyl]phenyl]benzene-1,4-diamine
CID 162077719
N,N-diphenyl-4-[4-(N-phenylanilino)phenyl]aniline;N,N-diphenyl-4-[4-(N-[4-[4-(N-[4-[4-(N-phenylanilino)phenyl]phenyl]anilino)phenyl]phenyl]anilino)phenyl]aniline;N,N-diphenyl-4-[4-[4-(N-[4-[4-(N-[4-[4-[4-(N-phenylanilino)phenyl]phenyl]phenyl]anilino)phenyl]phenyl]anilino)phenyl]phenyl]aniline
CID 158321968
N-[4-[dimethoxy(methyl)silyl]phenyl]-4-[4-(N-[4-[dimethoxy(methyl)silyl]phenyl]anilino)phenyl]-N-phenylaniline
CID 58879109
ethane;tris(4-methyl-N,N-diphenylaniline)
CID 159159918
N,N-diphenylaniline;ethene
CID 135186601
acetylene;N,N-diphenylaniline
CID 162160270
azane;N,N-diphenylaniline;methane
CID 174725062

Frequently Asked Questions

What is the IUPAC name of 4-[dichloro(ethyl)silyl]-N,N-diphenylaniline?
The IUPAC name of 4-[dichloro(ethyl)silyl]-N,N-diphenylaniline (CID 23434748) is 4-[dichloro(ethyl)silyl]-N,N-diphenylaniline.
What is the SMILES notation for 4-[dichloro(ethyl)silyl]-N,N-diphenylaniline?
The canonical SMILES for 4-[dichloro(ethyl)silyl]-N,N-diphenylaniline is CC[Si](Cl)(Cl)c1ccc(N(c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of 4-[dichloro(ethyl)silyl]-N,N-diphenylaniline?
The InChIKey is HJFGKOQUGXVWQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19Cl2NSi/c1-2-24(21,22)20-15-13-19(14-16-20)23(17-9-5-3-6-10-17)18-11-7-4-8-12-18/h3-16H,2H2,1H3.
What are the key properties of 4-[dichloro(ethyl)silyl]-N,N-diphenylaniline?
4-[dichloro(ethyl)silyl]-N,N-diphenylaniline has a molecular weight of 372.37 g/mol, XLogP of 6.30, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[dichloro(ethyl)silyl]-N,N-diphenylaniline is sourced from PubChem (CID 23434748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).