3-[(2-hydroxyphenyl)diazenyl]-1-prop-2-enylindol-2-ol

C17H15N3O2 — CID 135857069

IUPAC3-[(2-hydroxyphenyl)diazenyl]-1-prop-2-enylindol-2-ol
SMILESC=CCn1c(O)c(/N=N/c2ccccc2O)c2ccccc21
InChIInChI=1S/C17H15N3O2/c1-2-11-20-14-9-5-3-7-12(14)16(17(20)22)19-18-13-8-4-6-10-15(13)21/h2-10,21-22H,1,11H2/b19-18+
InChIKeyBGWLQENWEYEDFQ-VHEBQXMUSA-N
MW293.33 g/mol
LogP4.65
Rot. Bonds4

About 3-[(2-hydroxyphenyl)diazenyl]-1-prop-2-enylindol-2-ol

3-[(2-hydroxyphenyl)diazenyl]-1-prop-2-enylindol-2-ol (PubChem CID 135857069) has the molecular formula C17H15N3O2 and a molecular weight of 293.33 g/mol. Its IUPAC name is 3-[(2-hydroxyphenyl)diazenyl]-1-prop-2-enylindol-2-ol.

Molecular Properties

Compound Name3-[(2-hydroxyphenyl)diazenyl]-1-prop-2-enylindol-2-ol
PubChem CID135857069
Molecular FormulaC17H15N3O2
Molecular Weight293.33 g/mol
Exact Mass293.12
IUPAC Name3-[(2-hydroxyphenyl)diazenyl]-1-prop-2-enylindol-2-ol
SMILESC=CCn1c(O)c(/N=N/c2ccccc2O)c2ccccc21
InChIInChI=1S/C17H15N3O2/c1-2-11-20-14-9-5-3-7-12(14)16(17(20)22)19-18-13-8-4-6-10-15(13)21/h2-10,21-22H,1,11H2/b19-18+
InChIKeyBGWLQENWEYEDFQ-VHEBQXMUSA-N
XLogP4.65
TPSA70.11 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.33
LogP ≤ 54.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N'-(1-Hexyl-2-oxoindolin-3-ylidene)benzohydrazide
CID 135743701
Methisazone
CID 667492
Bzo-poxizid
CID 2691386
Bzo-chmoxizid
CID 135881485
1-Methyl-3-(phenyl-hydrazono)-1,3-dihydro-indol-2-one
CID 2767481
3-(Phenyl-hydrazono)-1,3-dihydro-indol-2-one
CID 272989
(E)-1-benzyl-3-(hydroxyimino)indolin-2-one
CID 921636
Isatin 3-hydrazone
CID 16906
(Z)-3-(Hydroxyimino)-1-methylindolin-2-one
CID 18631
2(4-Benzyl-1-piperazinyl)N'-(2-oxo-1,2-dihydro-3H-indol-3-ylidene)acetohydrazide
CID 1034069
1-Ethyl-3-hydrazono-1,3-dihydro-indol-2-one
CID 2386107
2-(3-Hydrazono-2-oxo-2,3-dihydro-indol-1-yl)-N-phenyl-acetamide
CID 678592

Frequently Asked Questions

What is the IUPAC name of 3-[(2-hydroxyphenyl)diazenyl]-1-prop-2-enylindol-2-ol?
The IUPAC name of 3-[(2-hydroxyphenyl)diazenyl]-1-prop-2-enylindol-2-ol (CID 135857069) is 3-[(2-hydroxyphenyl)diazenyl]-1-prop-2-enylindol-2-ol.
What is the SMILES notation for 3-[(2-hydroxyphenyl)diazenyl]-1-prop-2-enylindol-2-ol?
The canonical SMILES for 3-[(2-hydroxyphenyl)diazenyl]-1-prop-2-enylindol-2-ol is C=CCn1c(O)c(/N=N/c2ccccc2O)c2ccccc21.
What is the InChIKey of 3-[(2-hydroxyphenyl)diazenyl]-1-prop-2-enylindol-2-ol?
The InChIKey is BGWLQENWEYEDFQ-VHEBQXMUSA-N. The full InChI is InChI=1S/C17H15N3O2/c1-2-11-20-14-9-5-3-7-12(14)16(17(20)22)19-18-13-8-4-6-10-15(13)21/h2-10,21-22H,1,11H2/b19-18+.
What are the key properties of 3-[(2-hydroxyphenyl)diazenyl]-1-prop-2-enylindol-2-ol?
3-[(2-hydroxyphenyl)diazenyl]-1-prop-2-enylindol-2-ol has a molecular weight of 293.33 g/mol, XLogP of 4.65, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-hydroxyphenyl)diazenyl]-1-prop-2-enylindol-2-ol is sourced from PubChem (CID 135857069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).