(5S)-5-[(1R)-1-hydroxyethyl]-3-thiophen-2-ylimidazolidine-2,4-dione

C9H10N2O3S — CID 102035530

IUPAC(5S)-5-[(1R)-1-hydroxyethyl]-3-thiophen-2-ylimidazolidine-2,4-dione
SMILESC[C@@H](O)[C@@H]1NC(=O)N(c2cccs2)C1=O
InChIInChI=1S/C9H10N2O3S/c1-5(12)7-8(13)11(9(14)10-7)6-3-2-4-15-6/h2-5,7,12H,1H3,(H,10,14)/t5-,7+/m1/s1
InChIKeyDMGWAOBJVLTZOA-VDTYLAMSSA-N
MW226.26 g/mol
LogP0.55
Rot. Bonds2

About (5S)-5-[(1R)-1-hydroxyethyl]-3-thiophen-2-ylimidazolidine-2,4-dione

(5S)-5-[(1R)-1-hydroxyethyl]-3-thiophen-2-ylimidazolidine-2,4-dione (PubChem CID 102035530) has the molecular formula C9H10N2O3S and a molecular weight of 226.26 g/mol. Its IUPAC name is (5S)-5-[(1R)-1-hydroxyethyl]-3-thiophen-2-ylimidazolidine-2,4-dione.

Molecular Properties

Compound Name(5S)-5-[(1R)-1-hydroxyethyl]-3-thiophen-2-ylimidazolidine-2,4-dione
PubChem CID102035530
Molecular FormulaC9H10N2O3S
Molecular Weight226.26 g/mol
Exact Mass226.04
IUPAC Name(5S)-5-[(1R)-1-hydroxyethyl]-3-thiophen-2-ylimidazolidine-2,4-dione
SMILESC[C@@H](O)[C@@H]1NC(=O)N(c2cccs2)C1=O
InChIInChI=1S/C9H10N2O3S/c1-5(12)7-8(13)11(9(14)10-7)6-3-2-4-15-6/h2-5,7,12H,1H3,(H,10,14)/t5-,7+/m1/s1
InChIKeyDMGWAOBJVLTZOA-VDTYLAMSSA-N
XLogP0.55
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.26
LogP ≤ 50.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze (5S)-5-[(1R)-1-hydroxyethyl]-3-thiophen-2-ylimidazolidine-2,4-dione with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(5S)-5-propan-2-yl-3-thiophen-2-ylimidazolidine-2,4-dione
CID 102035528
(5S)-5-methyl-3-thiophen-2-ylimidazolidine-2,4-dione
CID 131070623
(7S,7aS)-7-hydroxy-2-thiophen-2-yl-5,6,7,7a-tetrahydropyrrolo[1,2-c]imidazole-1,3-dione
CID 134831476
(5S)-5-(2-methylsulfanylethyl)-3-thiophen-2-ylimidazolidine-2,4-dione
CID 134856919
5-Butyl-3-thiophen-2-ylimidazolidine-2,4-dione
CID 16660097
5-Propan-2-yl-3-thiophen-2-ylimidazolidine-2,4-dione
CID 16660251
5-Methyl-3-thiophen-2-ylimidazolidine-2,4-dione
CID 16660255
N-[(4S)-3-oxo-1,2-oxazolidin-4-yl]-N-thiophen-2-ylacetamide
CID 67901987
(5S)-5-(hydroxymethyl)-3-thiophen-3-ylimidazolidine-2,4-dione
CID 102323011
(5S)-5-(1-hydroxyethyl)-3-thiophen-3-ylimidazolidine-2,4-dione
CID 102323012
2-amino-3-hydroxy-N-methyl-N-thiophen-2-ylpropanamide
CID 115179675

Frequently Asked Questions

What is the IUPAC name of (5S)-5-[(1R)-1-hydroxyethyl]-3-thiophen-2-ylimidazolidine-2,4-dione?
The IUPAC name of (5S)-5-[(1R)-1-hydroxyethyl]-3-thiophen-2-ylimidazolidine-2,4-dione (CID 102035530) is (5S)-5-[(1R)-1-hydroxyethyl]-3-thiophen-2-ylimidazolidine-2,4-dione.
What is the SMILES notation for (5S)-5-[(1R)-1-hydroxyethyl]-3-thiophen-2-ylimidazolidine-2,4-dione?
The canonical SMILES for (5S)-5-[(1R)-1-hydroxyethyl]-3-thiophen-2-ylimidazolidine-2,4-dione is C[C@@H](O)[C@@H]1NC(=O)N(c2cccs2)C1=O.
What is the InChIKey of (5S)-5-[(1R)-1-hydroxyethyl]-3-thiophen-2-ylimidazolidine-2,4-dione?
The InChIKey is DMGWAOBJVLTZOA-VDTYLAMSSA-N. The full InChI is InChI=1S/C9H10N2O3S/c1-5(12)7-8(13)11(9(14)10-7)6-3-2-4-15-6/h2-5,7,12H,1H3,(H,10,14)/t5-,7+/m1/s1.
What are the key properties of (5S)-5-[(1R)-1-hydroxyethyl]-3-thiophen-2-ylimidazolidine-2,4-dione?
(5S)-5-[(1R)-1-hydroxyethyl]-3-thiophen-2-ylimidazolidine-2,4-dione has a molecular weight of 226.26 g/mol, XLogP of 0.55, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5S)-5-[(1R)-1-hydroxyethyl]-3-thiophen-2-ylimidazolidine-2,4-dione is sourced from PubChem (CID 102035530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).