2-ethylimino-5-(1,3-thiazol-2-yl)imidazolidin-4-one

C8H10N4OS — CID 136706810

IUPAC2-ethylimino-5-(1,3-thiazol-2-yl)imidazolidin-4-one
SMILESCC/N=C1\NC(=O)C(c2nccs2)N1
InChIInChI=1S/C8H10N4OS/c1-2-9-8-11-5(6(13)12-8)7-10-3-4-14-7/h3-5H,2H2,1H3,(H2,9,11,12,13)
InChIKeyJADQIBLXVBVTSA-UHFFFAOYSA-N
MW210.26 g/mol
LogP0.28
Rot. Bonds2

About 2-ethylimino-5-(1,3-thiazol-2-yl)imidazolidin-4-one

2-ethylimino-5-(1,3-thiazol-2-yl)imidazolidin-4-one (PubChem CID 136706810) has the molecular formula C8H10N4OS and a molecular weight of 210.26 g/mol. Its IUPAC name is 2-ethylimino-5-(1,3-thiazol-2-yl)imidazolidin-4-one.

Molecular Properties

Compound Name2-ethylimino-5-(1,3-thiazol-2-yl)imidazolidin-4-one
PubChem CID136706810
Molecular FormulaC8H10N4OS
Molecular Weight210.26 g/mol
Exact Mass210.06
IUPAC Name2-ethylimino-5-(1,3-thiazol-2-yl)imidazolidin-4-one
SMILESCC/N=C1\NC(=O)C(c2nccs2)N1
InChIInChI=1S/C8H10N4OS/c1-2-9-8-11-5(6(13)12-8)7-10-3-4-14-7/h3-5H,2H2,1H3,(H2,9,11,12,13)
InChIKeyJADQIBLXVBVTSA-UHFFFAOYSA-N
XLogP0.28
TPSA66.38 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.26
LogP ≤ 50.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-(2-methylpropylimino)-5-(1,3-thiazol-2-yl)imidazolidin-4-one
CID 136706814
8-(1,3-thiazol-2-yl)spiro[4.5]decane-1,4-dione
CID 150389360
1-[4-(1,3-thiazol-2-yl)piperidin-1-yl]propan-1-one
CID 71692446
4,4-dimethyl-6-(1,3-thiazol-2-yl)cyclohex-2-en-1-one
CID 18320148
(5S)-5-(1,3-thiazol-2-yl)oxolan-2-one
CID 71354365
2-[(2R)-pyrrolidin-2-yl]-1,3-thiazole
CID 7047975
[6-(1,3-thiazol-2-yl)oxan-2-yl]methanamine
CID 130583812
4-(1,3-thiazol-2-yl)-1,3-thiazolidine 1-oxide
CID 123727875
N-ethyl-N-pyrrolidin-3-yl-1,3-thiazol-2-amine
CID 63300017
ethyl 2-methyl-4-(1,3-thiazol-2-yl)cyclohexane-1-carboxylate
CID 123485807
3-butan-2-yl-1-[2-(1,3-thiazol-2-yl)ethyl]piperazine-2,5-dione
CID 64970385
7-methyl-6-oxo-2-(1,3-thiazol-2-yl)-1,2,3,5-tetrahydropyrrolo[2,3-f]benzimidazole-7-carbonitrile
CID 70393900

Frequently Asked Questions

What is the IUPAC name of 2-ethylimino-5-(1,3-thiazol-2-yl)imidazolidin-4-one?
The IUPAC name of 2-ethylimino-5-(1,3-thiazol-2-yl)imidazolidin-4-one (CID 136706810) is 2-ethylimino-5-(1,3-thiazol-2-yl)imidazolidin-4-one.
What is the SMILES notation for 2-ethylimino-5-(1,3-thiazol-2-yl)imidazolidin-4-one?
The canonical SMILES for 2-ethylimino-5-(1,3-thiazol-2-yl)imidazolidin-4-one is CC/N=C1\NC(=O)C(c2nccs2)N1.
What is the InChIKey of 2-ethylimino-5-(1,3-thiazol-2-yl)imidazolidin-4-one?
The InChIKey is JADQIBLXVBVTSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N4OS/c1-2-9-8-11-5(6(13)12-8)7-10-3-4-14-7/h3-5H,2H2,1H3,(H2,9,11,12,13).
What are the key properties of 2-ethylimino-5-(1,3-thiazol-2-yl)imidazolidin-4-one?
2-ethylimino-5-(1,3-thiazol-2-yl)imidazolidin-4-one has a molecular weight of 210.26 g/mol, XLogP of 0.28, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethylimino-5-(1,3-thiazol-2-yl)imidazolidin-4-one is sourced from PubChem (CID 136706810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).