(3Z)-3-[(E)-(4-fluorophenyl)methylidenehydrazinylidene]-1H-indol-2-one

C15H10FN3O — CID 135425137

IUPAC(3Z)-3-[(E)-(4-fluorophenyl)methylidenehydrazinylidene]-1H-indol-2-one
SMILESO=C1Nc2ccccc2/C1=N/N=C/c1ccc(F)cc1
InChIInChI=1S/C15H10FN3O/c16-11-7-5-10(6-8-11)9-17-19-14-12-3-1-2-4-13(12)18-15(14)20/h1-9H,(H,18,19,20)/b17-9+
InChIKeyAETJSFRMENDYGC-RQZCQDPDSA-N
MW267.26 g/mol
LogP2.60
Rot. Bonds2

About (3Z)-3-[(E)-(4-fluorophenyl)methylidenehydrazinylidene]-1H-indol-2-one

(3Z)-3-[(E)-(4-fluorophenyl)methylidenehydrazinylidene]-1H-indol-2-one (PubChem CID 135425137) has the molecular formula C15H10FN3O and a molecular weight of 267.26 g/mol. Its IUPAC name is (3Z)-3-[(E)-(4-fluorophenyl)methylidenehydrazinylidene]-1H-indol-2-one.

Molecular Properties

Compound Name(3Z)-3-[(E)-(4-fluorophenyl)methylidenehydrazinylidene]-1H-indol-2-one
PubChem CID135425137
Molecular FormulaC15H10FN3O
Molecular Weight267.26 g/mol
Exact Mass267.08
IUPAC Name(3Z)-3-[(E)-(4-fluorophenyl)methylidenehydrazinylidene]-1H-indol-2-one
SMILESO=C1Nc2ccccc2/C1=N/N=C/c1ccc(F)cc1
InChIInChI=1S/C15H10FN3O/c16-11-7-5-10(6-8-11)9-17-19-14-12-3-1-2-4-13(12)18-15(14)20/h1-9H,(H,18,19,20)/b17-9+
InChIKeyAETJSFRMENDYGC-RQZCQDPDSA-N
XLogP2.60
TPSA53.82 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.26
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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'}

Analyze (3Z)-3-[(E)-(4-fluorophenyl)methylidenehydrazinylidene]-1H-indol-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (3Z)-3-[(E)-(4-fluorophenyl)methylidenehydrazinylidene]-1H-indol-2-one?
The IUPAC name of (3Z)-3-[(E)-(4-fluorophenyl)methylidenehydrazinylidene]-1H-indol-2-one (CID 135425137) is (3Z)-3-[(E)-(4-fluorophenyl)methylidenehydrazinylidene]-1H-indol-2-one.
What is the SMILES notation for (3Z)-3-[(E)-(4-fluorophenyl)methylidenehydrazinylidene]-1H-indol-2-one?
The canonical SMILES for (3Z)-3-[(E)-(4-fluorophenyl)methylidenehydrazinylidene]-1H-indol-2-one is O=C1Nc2ccccc2/C1=N/N=C/c1ccc(F)cc1.
What is the InChIKey of (3Z)-3-[(E)-(4-fluorophenyl)methylidenehydrazinylidene]-1H-indol-2-one?
The InChIKey is AETJSFRMENDYGC-RQZCQDPDSA-N. The full InChI is InChI=1S/C15H10FN3O/c16-11-7-5-10(6-8-11)9-17-19-14-12-3-1-2-4-13(12)18-15(14)20/h1-9H,(H,18,19,20)/b17-9+.
What are the key properties of (3Z)-3-[(E)-(4-fluorophenyl)methylidenehydrazinylidene]-1H-indol-2-one?
(3Z)-3-[(E)-(4-fluorophenyl)methylidenehydrazinylidene]-1H-indol-2-one has a molecular weight of 267.26 g/mol, XLogP of 2.60, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3Z)-3-[(E)-(4-fluorophenyl)methylidenehydrazinylidene]-1H-indol-2-one is sourced from PubChem (CID 135425137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).