1-(4-ethyl-1,3-thiazol-2-yl)imidazolidine-2,4-dione

C8H9N3O2S — CID 3060453

IUPAC1-(4-ethyl-1,3-thiazol-2-yl)imidazolidine-2,4-dione
SMILESCCc1csc(N2CC(=O)NC2=O)n1
InChIInChI=1S/C8H9N3O2S/c1-2-5-4-14-8(9-5)11-3-6(12)10-7(11)13/h4H,2-3H2,1H3,(H,10,12,13)
InChIKeyNXCPVRJFYMCGMY-UHFFFAOYSA-N
MW211.25 g/mol
LogP0.76
Rot. Bonds2

About 1-(4-ethyl-1,3-thiazol-2-yl)imidazolidine-2,4-dione

1-(4-ethyl-1,3-thiazol-2-yl)imidazolidine-2,4-dione (PubChem CID 3060453) has the molecular formula C8H9N3O2S and a molecular weight of 211.25 g/mol. Its IUPAC name is 1-(4-ethyl-1,3-thiazol-2-yl)imidazolidine-2,4-dione.

Molecular Properties

Compound Name1-(4-ethyl-1,3-thiazol-2-yl)imidazolidine-2,4-dione
PubChem CID3060453
Molecular FormulaC8H9N3O2S
Molecular Weight211.25 g/mol
Exact Mass211.04
IUPAC Name1-(4-ethyl-1,3-thiazol-2-yl)imidazolidine-2,4-dione
SMILESCCc1csc(N2CC(=O)NC2=O)n1
InChIInChI=1S/C8H9N3O2S/c1-2-5-4-14-8(9-5)11-3-6(12)10-7(11)13/h4H,2-3H2,1H3,(H,10,12,13)
InChIKeyNXCPVRJFYMCGMY-UHFFFAOYSA-N
XLogP0.76
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.25
LogP ≤ 50.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-(4-ethyl-1,3-thiazol-2-yl)imidazolidine-2,4-dione?
The IUPAC name of 1-(4-ethyl-1,3-thiazol-2-yl)imidazolidine-2,4-dione (CID 3060453) is 1-(4-ethyl-1,3-thiazol-2-yl)imidazolidine-2,4-dione.
What is the SMILES notation for 1-(4-ethyl-1,3-thiazol-2-yl)imidazolidine-2,4-dione?
The canonical SMILES for 1-(4-ethyl-1,3-thiazol-2-yl)imidazolidine-2,4-dione is CCc1csc(N2CC(=O)NC2=O)n1.
What is the InChIKey of 1-(4-ethyl-1,3-thiazol-2-yl)imidazolidine-2,4-dione?
The InChIKey is NXCPVRJFYMCGMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N3O2S/c1-2-5-4-14-8(9-5)11-3-6(12)10-7(11)13/h4H,2-3H2,1H3,(H,10,12,13).
What are the key properties of 1-(4-ethyl-1,3-thiazol-2-yl)imidazolidine-2,4-dione?
1-(4-ethyl-1,3-thiazol-2-yl)imidazolidine-2,4-dione has a molecular weight of 211.25 g/mol, XLogP of 0.76, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-ethyl-1,3-thiazol-2-yl)imidazolidine-2,4-dione is sourced from PubChem (CID 3060453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).