5-methyl-3-thiophen-2-ylimidazolidine-2,4-dione

C8H8N2O2S — CID 16660255

IUPAC5-methyl-3-thiophen-2-ylimidazolidine-2,4-dione
SMILESCC1NC(=O)N(c2cccs2)C1=O
InChIInChI=1S/C8H8N2O2S/c1-5-7(11)10(8(12)9-5)6-3-2-4-13-6/h2-5H,1H3,(H,9,12)
InChIKeyPIDUVEQPZNMOAL-UHFFFAOYSA-N
MW196.23 g/mol
LogP1.19
Rot. Bonds1

About 5-methyl-3-thiophen-2-ylimidazolidine-2,4-dione

5-methyl-3-thiophen-2-ylimidazolidine-2,4-dione (PubChem CID 16660255) has the molecular formula C8H8N2O2S and a molecular weight of 196.23 g/mol. Its IUPAC name is 5-methyl-3-thiophen-2-ylimidazolidine-2,4-dione.

Molecular Properties

Compound Name5-methyl-3-thiophen-2-ylimidazolidine-2,4-dione
PubChem CID16660255
Molecular FormulaC8H8N2O2S
Molecular Weight196.23 g/mol
Exact Mass196.03
IUPAC Name5-methyl-3-thiophen-2-ylimidazolidine-2,4-dione
SMILESCC1NC(=O)N(c2cccs2)C1=O
InChIInChI=1S/C8H8N2O2S/c1-5-7(11)10(8(12)9-5)6-3-2-4-13-6/h2-5H,1H3,(H,9,12)
InChIKeyPIDUVEQPZNMOAL-UHFFFAOYSA-N
XLogP1.19
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.23
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-3-thiophen-2-ylimidazolidine-2,4-dione?
The IUPAC name of 5-methyl-3-thiophen-2-ylimidazolidine-2,4-dione (CID 16660255) is 5-methyl-3-thiophen-2-ylimidazolidine-2,4-dione.
What is the SMILES notation for 5-methyl-3-thiophen-2-ylimidazolidine-2,4-dione?
The canonical SMILES for 5-methyl-3-thiophen-2-ylimidazolidine-2,4-dione is CC1NC(=O)N(c2cccs2)C1=O.
What is the InChIKey of 5-methyl-3-thiophen-2-ylimidazolidine-2,4-dione?
The InChIKey is PIDUVEQPZNMOAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N2O2S/c1-5-7(11)10(8(12)9-5)6-3-2-4-13-6/h2-5H,1H3,(H,9,12).
What are the key properties of 5-methyl-3-thiophen-2-ylimidazolidine-2,4-dione?
5-methyl-3-thiophen-2-ylimidazolidine-2,4-dione has a molecular weight of 196.23 g/mol, XLogP of 1.19, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-3-thiophen-2-ylimidazolidine-2,4-dione is sourced from PubChem (CID 16660255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).