(2E)-5-ethyl-2-[(E)-furan-2-ylmethylidenehydrazinylidene]-1,3-thiazolidin-4-one

C10H11N3O2S — CID 135401272

IUPAC(2E)-5-ethyl-2-[(E)-furan-2-ylmethylidenehydrazinylidene]-1,3-thiazolidin-4-one
SMILESCCC1S/C(=N/N=C/c2ccco2)NC1=O
InChIInChI=1S/C10H11N3O2S/c1-2-8-9(14)12-10(16-8)13-11-6-7-4-3-5-15-7/h3-6,8H,2H2,1H3,(H,12,13,14)/b11-6+
InChIKeyKMOJYSLOIJOPQE-IZZDOVSWSA-N
MW237.28 g/mol
LogP1.61
Rot. Bonds3

About (2E)-5-ethyl-2-[(E)-furan-2-ylmethylidenehydrazinylidene]-1,3-thiazolidin-4-one

(2E)-5-ethyl-2-[(E)-furan-2-ylmethylidenehydrazinylidene]-1,3-thiazolidin-4-one (PubChem CID 135401272) has the molecular formula C10H11N3O2S and a molecular weight of 237.28 g/mol. Its IUPAC name is (2E)-5-ethyl-2-[(E)-furan-2-ylmethylidenehydrazinylidene]-1,3-thiazolidin-4-one.

Molecular Properties

Compound Name(2E)-5-ethyl-2-[(E)-furan-2-ylmethylidenehydrazinylidene]-1,3-thiazolidin-4-one
PubChem CID135401272
Molecular FormulaC10H11N3O2S
Molecular Weight237.28 g/mol
Exact Mass237.06
IUPAC Name(2E)-5-ethyl-2-[(E)-furan-2-ylmethylidenehydrazinylidene]-1,3-thiazolidin-4-one
SMILESCCC1S/C(=N/N=C/c2ccco2)NC1=O
InChIInChI=1S/C10H11N3O2S/c1-2-8-9(14)12-10(16-8)13-11-6-7-4-3-5-15-7/h3-6,8H,2H2,1H3,(H,12,13,14)/b11-6+
InChIKeyKMOJYSLOIJOPQE-IZZDOVSWSA-N
XLogP1.61
TPSA66.96 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.28
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze (2E)-5-ethyl-2-[(E)-furan-2-ylmethylidenehydrazinylidene]-1,3-thiazolidin-4-one with MolForge

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

Launch Full Analysis

Related Compounds

(2E)-5-(4-fluorobenzyl)-2-[(2E)-(furan-2-ylmethylidene)hydrazinylidene]-1,3-thiazolidin-4-one
CID 135472740
2-(Furan-2-ylmethylene-hydrazono)-5-(3-methyl-benzyl)-thiazolidin-4-one
CID 135455122
5-Methyl-2-furaldehyde (4-oxo-4,5-dihydro-1,3-thiazol-2-yl)hydrazone
CID 135472705
N-(4,5-dihydro-1,3-thiazol-2-yl)-3-(2-furyl)acrylamide
CID 801586
methyl [2-[2-(2-furylmethylene)hydrazino]-4-oxo-1,3-thiazol-5(4H)-ylidene]acetate
CID 135455167
(E)-methyl 2-(2-((E)-2-(furan-2-ylmethylene)hydrazinyl)-4-oxothiazol-5(4H)-ylidene)acetate
CID 135402708
5-Methyl-1,3-thiazolidine-2,4-dione 2-{[1-(2-furyl)ethylidene]hydrazone}
CID 135438835
(2Z)-5-benzyl-2-[(2E)-(furan-2-ylmethylidene)hydrazinylidene]-2,5-dihydro-1,3-thiazol-4-ol
CID 135439646
(E)-2-((E)-(furan-2-ylmethylene)hydrazono)-5-(4-methylbenzyl)thiazolidin-4-one
CID 135472852
(2E)-2-[(Z)-1-(furan-2-yl)ethylidenehydrazinylidene]-1,3-thiazolidin-4-one
CID 137100917
{(2E)-2-[(2E)-2-(2-furylmethylene)hydrazono]-4-oxo-1,3-thiazolidin-5-yl}acetic acid
CID 135457569
2-Furaldehyde (5-butyl-4-oxo-1,3-thiazolidin-2-ylidene)hydrazone
CID 135401460

Frequently Asked Questions

What is the IUPAC name of (2E)-5-ethyl-2-[(E)-furan-2-ylmethylidenehydrazinylidene]-1,3-thiazolidin-4-one?
The IUPAC name of (2E)-5-ethyl-2-[(E)-furan-2-ylmethylidenehydrazinylidene]-1,3-thiazolidin-4-one (CID 135401272) is (2E)-5-ethyl-2-[(E)-furan-2-ylmethylidenehydrazinylidene]-1,3-thiazolidin-4-one.
What is the SMILES notation for (2E)-5-ethyl-2-[(E)-furan-2-ylmethylidenehydrazinylidene]-1,3-thiazolidin-4-one?
The canonical SMILES for (2E)-5-ethyl-2-[(E)-furan-2-ylmethylidenehydrazinylidene]-1,3-thiazolidin-4-one is CCC1S/C(=N/N=C/c2ccco2)NC1=O.
What is the InChIKey of (2E)-5-ethyl-2-[(E)-furan-2-ylmethylidenehydrazinylidene]-1,3-thiazolidin-4-one?
The InChIKey is KMOJYSLOIJOPQE-IZZDOVSWSA-N. The full InChI is InChI=1S/C10H11N3O2S/c1-2-8-9(14)12-10(16-8)13-11-6-7-4-3-5-15-7/h3-6,8H,2H2,1H3,(H,12,13,14)/b11-6+.
What are the key properties of (2E)-5-ethyl-2-[(E)-furan-2-ylmethylidenehydrazinylidene]-1,3-thiazolidin-4-one?
(2E)-5-ethyl-2-[(E)-furan-2-ylmethylidenehydrazinylidene]-1,3-thiazolidin-4-one has a molecular weight of 237.28 g/mol, XLogP of 1.61, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2E)-5-ethyl-2-[(E)-furan-2-ylmethylidenehydrazinylidene]-1,3-thiazolidin-4-one is sourced from PubChem (CID 135401272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).