2-[(3,5-dimethylphenyl)diazenyl]-4-methylphenol

C15H16N2O — CID 3520182

IUPAC2-[(3,5-dimethylphenyl)diazenyl]-4-methylphenol
SMILESCc1cc(C)cc(/N=N/c2cc(C)ccc2O)c1
InChIInChI=1S/C15H16N2O/c1-10-4-5-15(18)14(9-10)17-16-13-7-11(2)6-12(3)8-13/h4-9,18H,1-3H3/b17-16+
InChIKeyKPZFZSXCDYBPAQ-WUKNDPDISA-N
MW240.31 g/mol
LogP4.73
Rot. Bonds2

About 2-[(3,5-dimethylphenyl)diazenyl]-4-methylphenol

2-[(3,5-dimethylphenyl)diazenyl]-4-methylphenol (PubChem CID 3520182) has the molecular formula C15H16N2O and a molecular weight of 240.31 g/mol. Its IUPAC name is 2-[(3,5-dimethylphenyl)diazenyl]-4-methylphenol.

Molecular Properties

Compound Name2-[(3,5-dimethylphenyl)diazenyl]-4-methylphenol
PubChem CID3520182
Molecular FormulaC15H16N2O
Molecular Weight240.31 g/mol
Exact Mass240.13
IUPAC Name2-[(3,5-dimethylphenyl)diazenyl]-4-methylphenol
SMILESCc1cc(C)cc(/N=N/c2cc(C)ccc2O)c1
InChIInChI=1S/C15H16N2O/c1-10-4-5-15(18)14(9-10)17-16-13-7-11(2)6-12(3)8-13/h4-9,18H,1-3H3/b17-16+
InChIKeyKPZFZSXCDYBPAQ-WUKNDPDISA-N
XLogP4.73
TPSA44.95 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.31
LogP ≤ 54.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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

benzene;2-[(2-hydroxy-5-methylphenyl)diazenyl]-4-methylphenol
CID 160570750
4-methyl-2-[(4-phenyldiazenylphenyl)diazenyl]phenol
CID 3519903
1-[4-[(2-hydroxy-5-methylphenyl)diazenyl]phenyl]ethanone
CID 3514586
[2-[(2-hydroxy-5-methylphenyl)diazenyl]phenyl]methanediol
CID 5249734
5-methyl-2-[(4-methylphenyl)diazenyl]phenol
CID 135467997
8-[(3,5-dimethylphenyl)diazenyl]isoquinolin-5-ol
CID 136661697
2-[(2,6-diethylphenyl)diazenyl]-4-methylphenol
CID 136862367
[2-[4-[(2-hydroxy-5-methylphenyl)diazenyl]anilino]-2-oxoethyl]-trimethylazanium
CID 136707795
4-[(3,5-dimethylphenyl)diazenyl]-8-methoxynaphthalen-1-ol
CID 136662732
2-isocyanato-4-methylphenol
CID 83382946
2-acetamido-5-[(2-hydroxy-5-methylphenyl)diazenyl]benzenesulfonic acid
CID 135764710
2-[[2-amino-4-(4-methylphenyl)sulfanylphenyl]diazenyl]-4-methylphenol
CID 137196775

Frequently Asked Questions

What is the IUPAC name of 2-[(3,5-dimethylphenyl)diazenyl]-4-methylphenol?
The IUPAC name of 2-[(3,5-dimethylphenyl)diazenyl]-4-methylphenol (CID 3520182) is 2-[(3,5-dimethylphenyl)diazenyl]-4-methylphenol.
What is the SMILES notation for 2-[(3,5-dimethylphenyl)diazenyl]-4-methylphenol?
The canonical SMILES for 2-[(3,5-dimethylphenyl)diazenyl]-4-methylphenol is Cc1cc(C)cc(/N=N/c2cc(C)ccc2O)c1.
What is the InChIKey of 2-[(3,5-dimethylphenyl)diazenyl]-4-methylphenol?
The InChIKey is KPZFZSXCDYBPAQ-WUKNDPDISA-N. The full InChI is InChI=1S/C15H16N2O/c1-10-4-5-15(18)14(9-10)17-16-13-7-11(2)6-12(3)8-13/h4-9,18H,1-3H3/b17-16+.
What are the key properties of 2-[(3,5-dimethylphenyl)diazenyl]-4-methylphenol?
2-[(3,5-dimethylphenyl)diazenyl]-4-methylphenol has a molecular weight of 240.31 g/mol, XLogP of 4.73, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3,5-dimethylphenyl)diazenyl]-4-methylphenol is sourced from PubChem (CID 3520182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).