(2Z)-2-(1-cyclohexylethylidenehydrazinylidene)-1,3-thiazolidin-4-one

C11H17N3OS — CID 137190321

IUPAC(2Z)-2-(1-cyclohexylethylidenehydrazinylidene)-1,3-thiazolidin-4-one
SMILESCC(=N/N=C1/NC(=O)CS1)C1CCCCC1
InChIInChI=1S/C11H17N3OS/c1-8(9-5-3-2-4-6-9)13-14-11-12-10(15)7-16-11/h9H,2-7H2,1H3,(H,12,14,15)
InChIKeyAUDQMTZYFIQVAJ-UHFFFAOYSA-N
MW239.34 g/mol
LogP2.16
Rot. Bonds2

About (2Z)-2-(1-cyclohexylethylidenehydrazinylidene)-1,3-thiazolidin-4-one

(2Z)-2-(1-cyclohexylethylidenehydrazinylidene)-1,3-thiazolidin-4-one (PubChem CID 137190321) has the molecular formula C11H17N3OS and a molecular weight of 239.34 g/mol. Its IUPAC name is (2Z)-2-(1-cyclohexylethylidenehydrazinylidene)-1,3-thiazolidin-4-one.

Molecular Properties

Compound Name(2Z)-2-(1-cyclohexylethylidenehydrazinylidene)-1,3-thiazolidin-4-one
PubChem CID137190321
Molecular FormulaC11H17N3OS
Molecular Weight239.34 g/mol
Exact Mass239.11
IUPAC Name(2Z)-2-(1-cyclohexylethylidenehydrazinylidene)-1,3-thiazolidin-4-one
SMILESCC(=N/N=C1/NC(=O)CS1)C1CCCCC1
InChIInChI=1S/C11H17N3OS/c1-8(9-5-3-2-4-6-9)13-14-11-12-10(15)7-16-11/h9H,2-7H2,1H3,(H,12,14,15)
InChIKeyAUDQMTZYFIQVAJ-UHFFFAOYSA-N
XLogP2.16
TPSA53.82 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.34
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

(2Z)-2-[(E)-1-cyclohexylethylidenehydrazinylidene]-1,3-thiazolidin-4-one
CID 137167956
(2E)-2-[(Z)-pentan-2-ylidenehydrazinylidene]-1,3-thiazolidin-4-one
CID 137100903
(2Z)-2-[(E)-1-(4-fluorophenyl)ethylidenehydrazinylidene]-1,3-thiazolidin-4-one
CID 135743595
2-cyclohexylimino-1,3-thiazolidin-4-one
CID 135416648
(2E)-2-[(E)-1-pyridin-4-ylethylidenehydrazinylidene]-1,3-thiazolidin-4-one
CID 137100920
2-[(Z)-1-(4-methoxyphenyl)ethylidenehydrazinylidene]-1,3-thiazolidin-4-one
CID 172943379
(2Z)-2-(1-thiophen-2-ylethylidenehydrazinylidene)-1,3-thiazolidin-4-one
CID 135760177
(2E)-2-[(Z)-(2-tert-butylcyclohexylidene)hydrazinylidene]-1,3-thiazolidin-4-one
CID 137100915
(3E)-1-cyclohexyl-3-(4-oxo-1,3-thiazolidin-2-ylidene)urea
CID 135643498
2-[1-(4-methyl-1,2,5-oxadiazol-3-yl)ethylidenehydrazinylidene]-1,3-thiazolidin-4-one
CID 135498282
2-methylimino-1,3-thiazolidin-4-one
CID 135778872
2-(cyclopropylmethylimino)-1,3-thiazolidin-4-one
CID 135990436

Frequently Asked Questions

What is the IUPAC name of (2Z)-2-(1-cyclohexylethylidenehydrazinylidene)-1,3-thiazolidin-4-one?
The IUPAC name of (2Z)-2-(1-cyclohexylethylidenehydrazinylidene)-1,3-thiazolidin-4-one (CID 137190321) is (2Z)-2-(1-cyclohexylethylidenehydrazinylidene)-1,3-thiazolidin-4-one.
What is the SMILES notation for (2Z)-2-(1-cyclohexylethylidenehydrazinylidene)-1,3-thiazolidin-4-one?
The canonical SMILES for (2Z)-2-(1-cyclohexylethylidenehydrazinylidene)-1,3-thiazolidin-4-one is CC(=N/N=C1/NC(=O)CS1)C1CCCCC1.
What is the InChIKey of (2Z)-2-(1-cyclohexylethylidenehydrazinylidene)-1,3-thiazolidin-4-one?
The InChIKey is AUDQMTZYFIQVAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3OS/c1-8(9-5-3-2-4-6-9)13-14-11-12-10(15)7-16-11/h9H,2-7H2,1H3,(H,12,14,15).
What are the key properties of (2Z)-2-(1-cyclohexylethylidenehydrazinylidene)-1,3-thiazolidin-4-one?
(2Z)-2-(1-cyclohexylethylidenehydrazinylidene)-1,3-thiazolidin-4-one has a molecular weight of 239.34 g/mol, XLogP of 2.16, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z)-2-(1-cyclohexylethylidenehydrazinylidene)-1,3-thiazolidin-4-one is sourced from PubChem (CID 137190321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).