4-[(diphenylhydrazinylidene)methyl]-N-ethenyl-N-ethylaniline

C23H23N3 — CID 59096400

IUPAC4-[(diphenylhydrazinylidene)methyl]-N-ethenyl-N-ethylaniline
SMILESC=CN(CC)c1ccc(C=NN(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C23H23N3/c1-3-25(4-2)21-17-15-20(16-18-21)19-24-26(22-11-7-5-8-12-22)23-13-9-6-10-14-23/h3,5-19H,1,4H2,2H3
InChIKeyCQTRHJWGYUHMRG-UHFFFAOYSA-N
MW341.46 g/mol
LogP5.83
Rot. Bonds7

About 4-[(diphenylhydrazinylidene)methyl]-N-ethenyl-N-ethylaniline

4-[(diphenylhydrazinylidene)methyl]-N-ethenyl-N-ethylaniline (PubChem CID 59096400) has the molecular formula C23H23N3 and a molecular weight of 341.46 g/mol. Its IUPAC name is 4-[(diphenylhydrazinylidene)methyl]-N-ethenyl-N-ethylaniline.

Molecular Properties

Compound Name4-[(diphenylhydrazinylidene)methyl]-N-ethenyl-N-ethylaniline
PubChem CID59096400
Molecular FormulaC23H23N3
Molecular Weight341.46 g/mol
Exact Mass341.19
IUPAC Name4-[(diphenylhydrazinylidene)methyl]-N-ethenyl-N-ethylaniline
SMILESC=CN(CC)c1ccc(C=NN(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C23H23N3/c1-3-25(4-2)21-17-15-20(16-18-21)19-24-26(22-11-7-5-8-12-22)23-13-9-6-10-14-23/h3,5-19H,1,4H2,2H3
InChIKeyCQTRHJWGYUHMRG-UHFFFAOYSA-N
XLogP5.83
TPSA18.84 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500341.46
LogP ≤ 55.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-[4-[(diphenylhydrazinylidene)methyl]phenyl]-4-methyl-N-(4-methylphenyl)aniline
CID 42614307
N-[(Z)-(4-methylsulfanylphenyl)methylideneamino]-N-phenylaniline
CID 6050776
4-(N-[(E)-[4-(N-(4-methylphenyl)anilino)phenyl]methylideneamino]anilino)benzaldehyde
CID 90065532
4-(N-[(E)-[4-(4-methyl-N-(4-methylphenyl)anilino)phenyl]methylideneamino]anilino)benzaldehyde
CID 90065635
N-[(E)-[4-(diethylamino)phenyl]methylideneamino]-N-phenylnaphthalen-1-amine;4-[(E)-(diphenylhydrazinylidene)methyl]-N,N-diethylaniline
CID 87966041
N,N-diethyl-4-[[methyl(phenyl)hydrazinylidene]methyl]aniline
CID 54333940
N-[(E)-[4-(N-[4-(2,2-diphenylethenyl)phenyl]anilino)phenyl]methylideneamino]-4-methyl-N-(4-methylphenyl)aniline
CID 172928570
N-[(4-ethenylphenyl)methylideneamino]-N-phenylnaphthalen-1-amine
CID 58803530
N-[4-[(diphenylhydrazinylidene)methyl]phenyl]-N-phenylquinolin-2-amine
CID 59967951
methyl 4-[(diphenylhydrazinylidene)methyl]benzoate
CID 5187336
2-[4-oxo-5-[[4-(N-[[4-(N-phenylanilino)phenyl]methylideneamino]anilino)phenyl]methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl]acetic acid
CID 90022837
4-[(E)-(dimethylhydrazinylidene)methyl]-N-methyl-N-phenylaniline
CID 56698447

Frequently Asked Questions

What is the IUPAC name of 4-[(diphenylhydrazinylidene)methyl]-N-ethenyl-N-ethylaniline?
The IUPAC name of 4-[(diphenylhydrazinylidene)methyl]-N-ethenyl-N-ethylaniline (CID 59096400) is 4-[(diphenylhydrazinylidene)methyl]-N-ethenyl-N-ethylaniline.
What is the SMILES notation for 4-[(diphenylhydrazinylidene)methyl]-N-ethenyl-N-ethylaniline?
The canonical SMILES for 4-[(diphenylhydrazinylidene)methyl]-N-ethenyl-N-ethylaniline is C=CN(CC)c1ccc(C=NN(c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of 4-[(diphenylhydrazinylidene)methyl]-N-ethenyl-N-ethylaniline?
The InChIKey is CQTRHJWGYUHMRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N3/c1-3-25(4-2)21-17-15-20(16-18-21)19-24-26(22-11-7-5-8-12-22)23-13-9-6-10-14-23/h3,5-19H,1,4H2,2H3.
What are the key properties of 4-[(diphenylhydrazinylidene)methyl]-N-ethenyl-N-ethylaniline?
4-[(diphenylhydrazinylidene)methyl]-N-ethenyl-N-ethylaniline has a molecular weight of 341.46 g/mol, XLogP of 5.83, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(diphenylhydrazinylidene)methyl]-N-ethenyl-N-ethylaniline is sourced from PubChem (CID 59096400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).