3-[(4-hydroxyphenyl)diazenyl]indol-2-one

C14H9N3O2 — CID 137203331

IUPAC3-[(4-hydroxyphenyl)diazenyl]indol-2-one
SMILESO=C1N=c2ccccc2=C1/N=N/c1ccc(O)cc1
InChIInChI=1S/C14H9N3O2/c18-10-7-5-9(6-8-10)16-17-13-11-3-1-2-4-12(11)15-14(13)19/h1-8,18H/b17-16+
InChIKeyQKJNNRQMFJHSAY-WUKNDPDISA-N
MW251.25 g/mol
LogP1.44
Rot. Bonds2

About 3-[(4-hydroxyphenyl)diazenyl]indol-2-one

3-[(4-hydroxyphenyl)diazenyl]indol-2-one (PubChem CID 137203331) has the molecular formula C14H9N3O2 and a molecular weight of 251.25 g/mol. Its IUPAC name is 3-[(4-hydroxyphenyl)diazenyl]indol-2-one.

Molecular Properties

Compound Name3-[(4-hydroxyphenyl)diazenyl]indol-2-one
PubChem CID137203331
Molecular FormulaC14H9N3O2
Molecular Weight251.25 g/mol
Exact Mass251.07
IUPAC Name3-[(4-hydroxyphenyl)diazenyl]indol-2-one
SMILESO=C1N=c2ccccc2=C1/N=N/c1ccc(O)cc1
InChIInChI=1S/C14H9N3O2/c18-10-7-5-9(6-8-10)16-17-13-11-3-1-2-4-12(11)15-14(13)19/h1-8,18H/b17-16+
InChIKeyQKJNNRQMFJHSAY-WUKNDPDISA-N
XLogP1.44
TPSA74.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.25
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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

4-[[2-[(4-hydroxyphenyl)diazenyl]phenyl]diazenyl]phenol
CID 174765894
4-[(4-methylphenyl)diazenyl]phenol
CID 2827322
4-[[4-[4-[(4-hydroxyphenyl)diazenyl]phenyl]sulfonylphenyl]diazenyl]phenol
CID 135852852
3-(1-chloro-2-fluoroethyl)indol-2-one
CID 175017063
(4aZ,6E,10aZ,12E)-6,12-dichlorobenzo[c][1,5]benzodiazocine
CID 15961548
ethane;4-[[4-[(4-hydroxyphenyl)diazenyl]phenyl]diazenyl]benzaldehyde
CID 136654998
6-hydroxy-5-(2-oxoindol-3-yl)-1H-pyrimidine-2,4-dione;hydrate
CID 135891515
3-(1H-pyrrole-2-carbonyl)indol-2-one
CID 70386379
4-[(4-hydroxyphenyl)diazenyl]-5-methyl-2-phenyl-1H-pyrazol-3-one
CID 811786
indol-2-one;phenol
CID 175483332
N-[6-amino-3-hydroxy-5-[(4-hydroxyphenyl)diazenyl]-2-pyridinyl]acetamide
CID 174261670
3-[2-hydroxy-5-(5-hydroxy-1H-indol-3-yl)-(3,4-13C2)1H-pyrrol-3-yl]indol-2-one
CID 135465957

Frequently Asked Questions

What is the IUPAC name of 3-[(4-hydroxyphenyl)diazenyl]indol-2-one?
The IUPAC name of 3-[(4-hydroxyphenyl)diazenyl]indol-2-one (CID 137203331) is 3-[(4-hydroxyphenyl)diazenyl]indol-2-one.
What is the SMILES notation for 3-[(4-hydroxyphenyl)diazenyl]indol-2-one?
The canonical SMILES for 3-[(4-hydroxyphenyl)diazenyl]indol-2-one is O=C1N=c2ccccc2=C1/N=N/c1ccc(O)cc1.
What is the InChIKey of 3-[(4-hydroxyphenyl)diazenyl]indol-2-one?
The InChIKey is QKJNNRQMFJHSAY-WUKNDPDISA-N. The full InChI is InChI=1S/C14H9N3O2/c18-10-7-5-9(6-8-10)16-17-13-11-3-1-2-4-12(11)15-14(13)19/h1-8,18H/b17-16+.
What are the key properties of 3-[(4-hydroxyphenyl)diazenyl]indol-2-one?
3-[(4-hydroxyphenyl)diazenyl]indol-2-one has a molecular weight of 251.25 g/mol, XLogP of 1.44, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(4-hydroxyphenyl)diazenyl]indol-2-one is sourced from PubChem (CID 137203331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).