2-[(2,4-dichlorophenyl)iminomethyl]-N,4-dimethyl-N-trimethylsilylaniline

C18H22Cl2N2Si — CID 21342260

IUPAC2-[(2,4-dichlorophenyl)iminomethyl]-N,4-dimethyl-N-trimethylsilylaniline
SMILESCc1ccc(N(C)[Si](C)(C)C)c(/C=N/c2ccc(Cl)cc2Cl)c1
InChIInChI=1S/C18H22Cl2N2Si/c1-13-6-9-18(22(2)23(3,4)5)14(10-13)12-21-17-8-7-15(19)11-16(17)20/h6-12H,1-5H3/b21-12+
InChIKeyATWSCVSXSVVBCD-CIAFOILYSA-N
MW365.38 g/mol
LogP6.32
Rot. Bonds4

About 2-[(2,4-dichlorophenyl)iminomethyl]-N,4-dimethyl-N-trimethylsilylaniline

2-[(2,4-dichlorophenyl)iminomethyl]-N,4-dimethyl-N-trimethylsilylaniline (PubChem CID 21342260) has the molecular formula C18H22Cl2N2Si and a molecular weight of 365.38 g/mol. Its IUPAC name is 2-[(2,4-dichlorophenyl)iminomethyl]-N,4-dimethyl-N-trimethylsilylaniline.

Molecular Properties

Compound Name2-[(2,4-dichlorophenyl)iminomethyl]-N,4-dimethyl-N-trimethylsilylaniline
PubChem CID21342260
Molecular FormulaC18H22Cl2N2Si
Molecular Weight365.38 g/mol
Exact Mass364.09
IUPAC Name2-[(2,4-dichlorophenyl)iminomethyl]-N,4-dimethyl-N-trimethylsilylaniline
SMILESCc1ccc(N(C)[Si](C)(C)C)c(/C=N/c2ccc(Cl)cc2Cl)c1
InChIInChI=1S/C18H22Cl2N2Si/c1-13-6-9-18(22(2)23(3,4)5)14(10-13)12-21-17-8-7-15(19)11-16(17)20/h6-12H,1-5H3/b21-12+
InChIKeyATWSCVSXSVVBCD-CIAFOILYSA-N
XLogP6.32
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500365.38
LogP ≤ 56.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-[(2,4-dichlorophenyl)iminomethyl]-N,4-dimethyl-N-trimethylsilylaniline?
The IUPAC name of 2-[(2,4-dichlorophenyl)iminomethyl]-N,4-dimethyl-N-trimethylsilylaniline (CID 21342260) is 2-[(2,4-dichlorophenyl)iminomethyl]-N,4-dimethyl-N-trimethylsilylaniline.
What is the SMILES notation for 2-[(2,4-dichlorophenyl)iminomethyl]-N,4-dimethyl-N-trimethylsilylaniline?
The canonical SMILES for 2-[(2,4-dichlorophenyl)iminomethyl]-N,4-dimethyl-N-trimethylsilylaniline is Cc1ccc(N(C)[Si](C)(C)C)c(/C=N/c2ccc(Cl)cc2Cl)c1.
What is the InChIKey of 2-[(2,4-dichlorophenyl)iminomethyl]-N,4-dimethyl-N-trimethylsilylaniline?
The InChIKey is ATWSCVSXSVVBCD-CIAFOILYSA-N. The full InChI is InChI=1S/C18H22Cl2N2Si/c1-13-6-9-18(22(2)23(3,4)5)14(10-13)12-21-17-8-7-15(19)11-16(17)20/h6-12H,1-5H3/b21-12+.
What are the key properties of 2-[(2,4-dichlorophenyl)iminomethyl]-N,4-dimethyl-N-trimethylsilylaniline?
2-[(2,4-dichlorophenyl)iminomethyl]-N,4-dimethyl-N-trimethylsilylaniline has a molecular weight of 365.38 g/mol, XLogP of 6.32, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2,4-dichlorophenyl)iminomethyl]-N,4-dimethyl-N-trimethylsilylaniline is sourced from PubChem (CID 21342260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).