benzhydryl-(4-methylphenyl)diazene

C20H18N2 — CID 91269446

IUPACbenzhydryl-(4-methylphenyl)diazene
SMILESCc1ccc(/N=N/C(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C20H18N2/c1-16-12-14-19(15-13-16)21-22-20(17-8-4-2-5-9-17)18-10-6-3-7-11-18/h2-15,20H,1H3/b22-21+
InChIKeySXBRJPCUSMLZPE-QURGRASLSA-N
MW286.38 g/mol
LogP5.87
Rot. Bonds4

About benzhydryl-(4-methylphenyl)diazene

benzhydryl-(4-methylphenyl)diazene (PubChem CID 91269446) has the molecular formula C20H18N2 and a molecular weight of 286.38 g/mol. Its IUPAC name is benzhydryl-(4-methylphenyl)diazene.

Molecular Properties

Compound Namebenzhydryl-(4-methylphenyl)diazene
PubChem CID91269446
Molecular FormulaC20H18N2
Molecular Weight286.38 g/mol
Exact Mass286.15
IUPAC Namebenzhydryl-(4-methylphenyl)diazene
SMILESCc1ccc(/N=N/C(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C20H18N2/c1-16-12-14-19(15-13-16)21-22-20(17-8-4-2-5-9-17)18-10-6-3-7-11-18/h2-15,20H,1H3/b22-21+
InChIKeySXBRJPCUSMLZPE-QURGRASLSA-N
XLogP5.87
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500286.38
LogP ≤ 55.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}

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Related Compounds

benzhydryl-(4-fluorophenyl)diazene
CID 91167183
bis(4-methylphenyl)diazene
CID 10389
2-amino-3-[4-(benzhydryldiazenyl)phenyl]propanoic acid
CID 123906750
1-[1-[(4-methylphenyl)diazenyl]ethyldiazenyl]ethanamine
CID 118893783
benzene;bis(1,4-xylene)
CID 159472747
[(S)-(4-methylphenyl)-phenylmethyl]azanium
CID 7127648
ethyl 2-[(4-methylphenyl)diazenyl]-3-oxo-3-phenylpropanoate
CID 54357705
4-(1-phenylethyldiazenyl)benzoic acid
CID 91596137
N-(4-methylphenyl)iminobenzenesulfonamide
CID 10869025
4-methyl-N-[(1R)-1-phenylethyl]-N-[(1S)-1-phenylethyl]aniline
CID 50900534
1-[isothiocyanato-(4-methylphenyl)methyl]-4-methylbenzene
CID 21312365
cumene;ethane;methane;1-methyl-4-propan-2-ylbenzene
CID 159265894

Frequently Asked Questions

What is the IUPAC name of benzhydryl-(4-methylphenyl)diazene?
The IUPAC name of benzhydryl-(4-methylphenyl)diazene (CID 91269446) is benzhydryl-(4-methylphenyl)diazene.
What is the SMILES notation for benzhydryl-(4-methylphenyl)diazene?
The canonical SMILES for benzhydryl-(4-methylphenyl)diazene is Cc1ccc(/N=N/C(c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of benzhydryl-(4-methylphenyl)diazene?
The InChIKey is SXBRJPCUSMLZPE-QURGRASLSA-N. The full InChI is InChI=1S/C20H18N2/c1-16-12-14-19(15-13-16)21-22-20(17-8-4-2-5-9-17)18-10-6-3-7-11-18/h2-15,20H,1H3/b22-21+.
What are the key properties of benzhydryl-(4-methylphenyl)diazene?
benzhydryl-(4-methylphenyl)diazene has a molecular weight of 286.38 g/mol, XLogP of 5.87, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for benzhydryl-(4-methylphenyl)diazene is sourced from PubChem (CID 91269446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).