4-[(E)-(diphenylhydrazinylidene)methyl]-3-methyl-N,N-diphenylaniline

C32H27N3 — CID 15044303

IUPAC4-[(E)-(diphenylhydrazinylidene)methyl]-3-methyl-N,N-diphenylaniline
SMILESCc1cc(N(c2ccccc2)c2ccccc2)ccc1/C=N/N(c1ccccc1)c1ccccc1
InChIInChI=1S/C32H27N3/c1-26-24-32(34(28-14-6-2-7-15-28)29-16-8-3-9-17-29)23-22-27(26)25-33-35(30-18-10-4-11-19-30)31-20-12-5-13-21-31/h2-25H,1H3/b33-25+
InChIKeyGJNJHHGYFSWHJY-INKHBPHZSA-N
MW453.59 g/mol
LogP8.64
Rot. Bonds7

About 4-[(E)-(diphenylhydrazinylidene)methyl]-3-methyl-N,N-diphenylaniline

4-[(E)-(diphenylhydrazinylidene)methyl]-3-methyl-N,N-diphenylaniline (PubChem CID 15044303) has the molecular formula C32H27N3 and a molecular weight of 453.59 g/mol. Its IUPAC name is 4-[(E)-(diphenylhydrazinylidene)methyl]-3-methyl-N,N-diphenylaniline.

Molecular Properties

Compound Name4-[(E)-(diphenylhydrazinylidene)methyl]-3-methyl-N,N-diphenylaniline
PubChem CID15044303
Molecular FormulaC32H27N3
Molecular Weight453.59 g/mol
Exact Mass453.22
IUPAC Name4-[(E)-(diphenylhydrazinylidene)methyl]-3-methyl-N,N-diphenylaniline
SMILESCc1cc(N(c2ccccc2)c2ccccc2)ccc1/C=N/N(c1ccccc1)c1ccccc1
InChIInChI=1S/C32H27N3/c1-26-24-32(34(28-14-6-2-7-15-28)29-16-8-3-9-17-29)23-22-27(26)25-33-35(30-18-10-4-11-19-30)31-20-12-5-13-21-31/h2-25H,1H3/b33-25+
InChIKeyGJNJHHGYFSWHJY-INKHBPHZSA-N
XLogP8.64
TPSA18.84 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500453.59
LogP ≤ 58.64
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

4-[(E)-(diphenylhydrazinylidene)methyl]-N-[4-[4-(N-[4-[(E)-(diphenylhydrazinylidene)methyl]-3-methylphenyl]-4-methylanilino)phenyl]phenyl]-3-methyl-N-(4-methylphenyl)aniline
CID 172986340
N-[4-[(diphenylhydrazinylidene)methyl]phenyl]-4-methyl-N-(4-methylphenyl)aniline
CID 42614307
3-methyl-N,N-diphenyl-4-(2-phenylethenyl)aniline
CID 54520687
N-[4-[(E)-2-[2-[(E)-2-[4-(N-(3,4-dimethylphenyl)anilino)-2-methylphenyl]ethenyl]phenyl]ethenyl]-3-methylphenyl]-3,4-dimethyl-N-phenylaniline
CID 22900179
N-(2,2-diphenylethenyl)-4-[(E)-(diphenylhydrazinylidene)methyl]-3-methyl-N-(4-methylcyclohexa-1,3-dien-1-yl)aniline
CID 131994994
5-(dimethylamino)-2-[(diphenylhydrazinylidene)methyl]phenol
CID 136612078
3-methyl-4-[2-[4-[2-[2-methyl-4-(N-(4-methylphenyl)anilino)phenyl]ethenyl]phenyl]ethenyl]-N-(4-methylphenyl)-N-phenylaniline
CID 59805392
3-methyl-4-[(E)-2-[2-[(E)-2-[2-methyl-4-(4-methyl-N-(4-methylphenyl)anilino)phenyl]ethenyl]phenyl]ethenyl]-N,N-bis(4-methylphenyl)aniline
CID 22899848
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
4-[(dimethylhydrazinylidene)methyl]-N,N,3-trimethylaniline
CID 59931546
N-[(E)-[4-(N-[4-(2,2-diphenylethenyl)phenyl]anilino)phenyl]methylideneamino]-4-methyl-N-(4-methylphenyl)aniline
CID 172928570

Frequently Asked Questions

What is the IUPAC name of 4-[(E)-(diphenylhydrazinylidene)methyl]-3-methyl-N,N-diphenylaniline?
The IUPAC name of 4-[(E)-(diphenylhydrazinylidene)methyl]-3-methyl-N,N-diphenylaniline (CID 15044303) is 4-[(E)-(diphenylhydrazinylidene)methyl]-3-methyl-N,N-diphenylaniline.
What is the SMILES notation for 4-[(E)-(diphenylhydrazinylidene)methyl]-3-methyl-N,N-diphenylaniline?
The canonical SMILES for 4-[(E)-(diphenylhydrazinylidene)methyl]-3-methyl-N,N-diphenylaniline is Cc1cc(N(c2ccccc2)c2ccccc2)ccc1/C=N/N(c1ccccc1)c1ccccc1.
What is the InChIKey of 4-[(E)-(diphenylhydrazinylidene)methyl]-3-methyl-N,N-diphenylaniline?
The InChIKey is GJNJHHGYFSWHJY-INKHBPHZSA-N. The full InChI is InChI=1S/C32H27N3/c1-26-24-32(34(28-14-6-2-7-15-28)29-16-8-3-9-17-29)23-22-27(26)25-33-35(30-18-10-4-11-19-30)31-20-12-5-13-21-31/h2-25H,1H3/b33-25+.
What are the key properties of 4-[(E)-(diphenylhydrazinylidene)methyl]-3-methyl-N,N-diphenylaniline?
4-[(E)-(diphenylhydrazinylidene)methyl]-3-methyl-N,N-diphenylaniline has a molecular weight of 453.59 g/mol, XLogP of 8.64, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(E)-(diphenylhydrazinylidene)methyl]-3-methyl-N,N-diphenylaniline is sourced from PubChem (CID 15044303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).