(3Z)-3-[(E)-(3-hydroxyphenyl)methylidenehydrazinylidene]-1H-indol-2-one

C15H11N3O2 — CID 135648569

IUPAC(3Z)-3-[(E)-(3-hydroxyphenyl)methylidenehydrazinylidene]-1H-indol-2-one
SMILESO=C1Nc2ccccc2/C1=N/N=C/c1cccc(O)c1
InChIInChI=1S/C15H11N3O2/c19-11-5-3-4-10(8-11)9-16-18-14-12-6-1-2-7-13(12)17-15(14)20/h1-9,19H,(H,17,18,20)/b16-9+
InChIKeyPLESVMIYTJFJPE-CXUHLZMHSA-N
MW265.27 g/mol
LogP2.17
Rot. Bonds2

About (3Z)-3-[(E)-(3-hydroxyphenyl)methylidenehydrazinylidene]-1H-indol-2-one

(3Z)-3-[(E)-(3-hydroxyphenyl)methylidenehydrazinylidene]-1H-indol-2-one (PubChem CID 135648569) has the molecular formula C15H11N3O2 and a molecular weight of 265.27 g/mol. Its IUPAC name is (3Z)-3-[(E)-(3-hydroxyphenyl)methylidenehydrazinylidene]-1H-indol-2-one.

Molecular Properties

Compound Name(3Z)-3-[(E)-(3-hydroxyphenyl)methylidenehydrazinylidene]-1H-indol-2-one
PubChem CID135648569
Molecular FormulaC15H11N3O2
Molecular Weight265.27 g/mol
Exact Mass265.09
IUPAC Name(3Z)-3-[(E)-(3-hydroxyphenyl)methylidenehydrazinylidene]-1H-indol-2-one
SMILESO=C1Nc2ccccc2/C1=N/N=C/c1cccc(O)c1
InChIInChI=1S/C15H11N3O2/c19-11-5-3-4-10(8-11)9-16-18-14-12-6-1-2-7-13(12)17-15(14)20/h1-9,19H,(H,17,18,20)/b16-9+
InChIKeyPLESVMIYTJFJPE-CXUHLZMHSA-N
XLogP2.17
TPSA74.05 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.27
LogP ≤ 52.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_one_isatin(189)', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (3Z)-3-[(E)-(3-hydroxyphenyl)methylidenehydrazinylidene]-1H-indol-2-one?
The IUPAC name of (3Z)-3-[(E)-(3-hydroxyphenyl)methylidenehydrazinylidene]-1H-indol-2-one (CID 135648569) is (3Z)-3-[(E)-(3-hydroxyphenyl)methylidenehydrazinylidene]-1H-indol-2-one.
What is the SMILES notation for (3Z)-3-[(E)-(3-hydroxyphenyl)methylidenehydrazinylidene]-1H-indol-2-one?
The canonical SMILES for (3Z)-3-[(E)-(3-hydroxyphenyl)methylidenehydrazinylidene]-1H-indol-2-one is O=C1Nc2ccccc2/C1=N/N=C/c1cccc(O)c1.
What is the InChIKey of (3Z)-3-[(E)-(3-hydroxyphenyl)methylidenehydrazinylidene]-1H-indol-2-one?
The InChIKey is PLESVMIYTJFJPE-CXUHLZMHSA-N. The full InChI is InChI=1S/C15H11N3O2/c19-11-5-3-4-10(8-11)9-16-18-14-12-6-1-2-7-13(12)17-15(14)20/h1-9,19H,(H,17,18,20)/b16-9+.
What are the key properties of (3Z)-3-[(E)-(3-hydroxyphenyl)methylidenehydrazinylidene]-1H-indol-2-one?
(3Z)-3-[(E)-(3-hydroxyphenyl)methylidenehydrazinylidene]-1H-indol-2-one has a molecular weight of 265.27 g/mol, XLogP of 2.17, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3Z)-3-[(E)-(3-hydroxyphenyl)methylidenehydrazinylidene]-1H-indol-2-one is sourced from PubChem (CID 135648569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).