(2E)-5-methyl-2-[(E)-pyridin-3-ylmethylidenehydrazinylidene]-1,3-thiazolidin-4-one

C10H10N4OS — CID 137175060

IUPAC(2E)-5-methyl-2-[(E)-pyridin-3-ylmethylidenehydrazinylidene]-1,3-thiazolidin-4-one
SMILESCC1S/C(=N/N=C/c2cccnc2)NC1=O
InChIInChI=1S/C10H10N4OS/c1-7-9(15)13-10(16-7)14-12-6-8-3-2-4-11-5-8/h2-7H,1H3,(H,13,14,15)/b12-6+
InChIKeyVTYYIGSBMPYSTJ-WUXMJOGZSA-N
MW234.28 g/mol
LogP1.02
Rot. Bonds2

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

(2E)-5-methyl-2-[(E)-pyridin-3-ylmethylidenehydrazinylidene]-1,3-thiazolidin-4-one (PubChem CID 137175060) has the molecular formula C10H10N4OS and a molecular weight of 234.28 g/mol. Its IUPAC name is (2E)-5-methyl-2-[(E)-pyridin-3-ylmethylidenehydrazinylidene]-1,3-thiazolidin-4-one.

Molecular Properties

Compound Name(2E)-5-methyl-2-[(E)-pyridin-3-ylmethylidenehydrazinylidene]-1,3-thiazolidin-4-one
PubChem CID137175060
Molecular FormulaC10H10N4OS
Molecular Weight234.28 g/mol
Exact Mass234.06
IUPAC Name(2E)-5-methyl-2-[(E)-pyridin-3-ylmethylidenehydrazinylidene]-1,3-thiazolidin-4-one
SMILESCC1S/C(=N/N=C/c2cccnc2)NC1=O
InChIInChI=1S/C10H10N4OS/c1-7-9(15)13-10(16-7)14-12-6-8-3-2-4-11-5-8/h2-7H,1H3,(H,13,14,15)/b12-6+
InChIKeyVTYYIGSBMPYSTJ-WUXMJOGZSA-N
XLogP1.02
TPSA66.71 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.28
LogP ≤ 51.02
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-methyl-2-[(E)-pyridin-3-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

Frequently Asked Questions

What is the IUPAC name of (2E)-5-methyl-2-[(E)-pyridin-3-ylmethylidenehydrazinylidene]-1,3-thiazolidin-4-one?
The IUPAC name of (2E)-5-methyl-2-[(E)-pyridin-3-ylmethylidenehydrazinylidene]-1,3-thiazolidin-4-one (CID 137175060) is (2E)-5-methyl-2-[(E)-pyridin-3-ylmethylidenehydrazinylidene]-1,3-thiazolidin-4-one.
What is the SMILES notation for (2E)-5-methyl-2-[(E)-pyridin-3-ylmethylidenehydrazinylidene]-1,3-thiazolidin-4-one?
The canonical SMILES for (2E)-5-methyl-2-[(E)-pyridin-3-ylmethylidenehydrazinylidene]-1,3-thiazolidin-4-one is CC1S/C(=N/N=C/c2cccnc2)NC1=O.
What is the InChIKey of (2E)-5-methyl-2-[(E)-pyridin-3-ylmethylidenehydrazinylidene]-1,3-thiazolidin-4-one?
The InChIKey is VTYYIGSBMPYSTJ-WUXMJOGZSA-N. The full InChI is InChI=1S/C10H10N4OS/c1-7-9(15)13-10(16-7)14-12-6-8-3-2-4-11-5-8/h2-7H,1H3,(H,13,14,15)/b12-6+.
What are the key properties of (2E)-5-methyl-2-[(E)-pyridin-3-ylmethylidenehydrazinylidene]-1,3-thiazolidin-4-one?
(2E)-5-methyl-2-[(E)-pyridin-3-ylmethylidenehydrazinylidene]-1,3-thiazolidin-4-one has a molecular weight of 234.28 g/mol, XLogP of 1.02, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2E)-5-methyl-2-[(E)-pyridin-3-ylmethylidenehydrazinylidene]-1,3-thiazolidin-4-one is sourced from PubChem (CID 137175060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).