4-[(E)-(diphenylhydrazinylidene)methyl]-2-methoxyphenol

C20H18N2O2 — CID 135444096

IUPAC4-[(E)-(diphenylhydrazinylidene)methyl]-2-methoxyphenol
SMILESCOc1cc(/C=N/N(c2ccccc2)c2ccccc2)ccc1O
InChIInChI=1S/C20H18N2O2/c1-24-20-14-16(12-13-19(20)23)15-21-22(17-8-4-2-5-9-17)18-10-6-3-7-11-18/h2-15,23H,1H3/b21-15+
InChIKeyKQEFTOVGCDTEQD-RCCKNPSSSA-N
MW318.38 g/mol
LogP4.57
Rot. Bonds5

About 4-[(E)-(diphenylhydrazinylidene)methyl]-2-methoxyphenol

4-[(E)-(diphenylhydrazinylidene)methyl]-2-methoxyphenol (PubChem CID 135444096) has the molecular formula C20H18N2O2 and a molecular weight of 318.38 g/mol. Its IUPAC name is 4-[(E)-(diphenylhydrazinylidene)methyl]-2-methoxyphenol.

Molecular Properties

Compound Name4-[(E)-(diphenylhydrazinylidene)methyl]-2-methoxyphenol
PubChem CID135444096
Molecular FormulaC20H18N2O2
Molecular Weight318.38 g/mol
Exact Mass318.14
IUPAC Name4-[(E)-(diphenylhydrazinylidene)methyl]-2-methoxyphenol
SMILESCOc1cc(/C=N/N(c2ccccc2)c2ccccc2)ccc1O
InChIInChI=1S/C20H18N2O2/c1-24-20-14-16(12-13-19(20)23)15-21-22(17-8-4-2-5-9-17)18-10-6-3-7-11-18/h2-15,23H,1H3/b21-15+
InChIKeyKQEFTOVGCDTEQD-RCCKNPSSSA-N
XLogP4.57
TPSA45.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.38
LogP ≤ 54.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hzone_phenol_B(215)', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

4-Hydroxy-3-methoxybenzaldehyde phenylhydrazone
CID 135684904
2,6-Dimethoxy-4-(((4-(2-methoxyphenyl)-1-piperazinyl)imino)methyl)phenol
CID 135498032
2-Methoxy-alpha-(4-methoxyphenylimino)-para-cresol
CID 681370
5-{[4-(4-Chloro-phenyl)-piperazin-1-ylimino]-methyl}-2-methoxy-phenol
CID 5726092
5-[(E)-[benzyl(phenyl)hydrazinylidene]methyl]-2-methoxyphenol
CID 9655904
4-[(E)-{[4-(2-methoxyphenyl)piperazin-1-yl]imino}methyl]benzene-1,2-diol
CID 135455093
1,3-Benzodioxole-5-carbaldehyde diphenylhydrazone
CID 5335108
4-{[(E)-(4-hydroxy-3-methoxyphenyl)methylidene]amino}-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
CID 402961
4-[(E)-(4-phenylpiperazin-1-yl)iminomethyl]benzene-1,2-diol
CID 135544867
5-(3,4-dimethoxyphenyl)-3-(4-methoxyphenyl)-1-phenyl-4,5-dihydro-1H-pyrazole
CID 3122025
4-Ethoxy-3-methoxybenzaldehyde methyl(phenyl)hydrazone
CID 5333431
1,3-Benzodioxole-5-carbaldehyde methyl(phenyl)hydrazone
CID 5333437

Frequently Asked Questions

What is the IUPAC name of 4-[(E)-(diphenylhydrazinylidene)methyl]-2-methoxyphenol?
The IUPAC name of 4-[(E)-(diphenylhydrazinylidene)methyl]-2-methoxyphenol (CID 135444096) is 4-[(E)-(diphenylhydrazinylidene)methyl]-2-methoxyphenol.
What is the SMILES notation for 4-[(E)-(diphenylhydrazinylidene)methyl]-2-methoxyphenol?
The canonical SMILES for 4-[(E)-(diphenylhydrazinylidene)methyl]-2-methoxyphenol is COc1cc(/C=N/N(c2ccccc2)c2ccccc2)ccc1O.
What is the InChIKey of 4-[(E)-(diphenylhydrazinylidene)methyl]-2-methoxyphenol?
The InChIKey is KQEFTOVGCDTEQD-RCCKNPSSSA-N. The full InChI is InChI=1S/C20H18N2O2/c1-24-20-14-16(12-13-19(20)23)15-21-22(17-8-4-2-5-9-17)18-10-6-3-7-11-18/h2-15,23H,1H3/b21-15+.
What are the key properties of 4-[(E)-(diphenylhydrazinylidene)methyl]-2-methoxyphenol?
4-[(E)-(diphenylhydrazinylidene)methyl]-2-methoxyphenol has a molecular weight of 318.38 g/mol, XLogP of 4.57, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(E)-(diphenylhydrazinylidene)methyl]-2-methoxyphenol is sourced from PubChem (CID 135444096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).