4-hydroxy-3-(3-methyl-1,2,4-thiadiazol-5-yl)-1-propan-2-ylimidazolidin-2-one

C9H14N4O2S — CID 135150447

IUPAC4-hydroxy-3-(3-methyl-1,2,4-thiadiazol-5-yl)-1-propan-2-ylimidazolidin-2-one
SMILESCc1nsc(N2C(=O)N(C(C)C)CC2O)n1
InChIInChI=1S/C9H14N4O2S/c1-5(2)12-4-7(14)13(9(12)15)8-10-6(3)11-16-8/h5,7,14H,4H2,1-3H3
InChIKeyZXAGFHWCHZWRNL-UHFFFAOYSA-N
MW242.30 g/mol
LogP0.82
Rot. Bonds2

About 4-hydroxy-3-(3-methyl-1,2,4-thiadiazol-5-yl)-1-propan-2-ylimidazolidin-2-one

4-hydroxy-3-(3-methyl-1,2,4-thiadiazol-5-yl)-1-propan-2-ylimidazolidin-2-one (PubChem CID 135150447) has the molecular formula C9H14N4O2S and a molecular weight of 242.30 g/mol. Its IUPAC name is 4-hydroxy-3-(3-methyl-1,2,4-thiadiazol-5-yl)-1-propan-2-ylimidazolidin-2-one.

Molecular Properties

Compound Name4-hydroxy-3-(3-methyl-1,2,4-thiadiazol-5-yl)-1-propan-2-ylimidazolidin-2-one
PubChem CID135150447
Molecular FormulaC9H14N4O2S
Molecular Weight242.30 g/mol
Exact Mass242.08
IUPAC Name4-hydroxy-3-(3-methyl-1,2,4-thiadiazol-5-yl)-1-propan-2-ylimidazolidin-2-one
SMILESCc1nsc(N2C(=O)N(C(C)C)CC2O)n1
InChIInChI=1S/C9H14N4O2S/c1-5(2)12-4-7(14)13(9(12)15)8-10-6(3)11-16-8/h5,7,14H,4H2,1-3H3
InChIKeyZXAGFHWCHZWRNL-UHFFFAOYSA-N
XLogP0.82
TPSA69.56 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.30
LogP ≤ 50.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4-hydroxy-3-(3-methyl-1,2,4-thiadiazol-5-yl)-1-propan-2-ylimidazolidin-2-one with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-3-(3-methyl-1,2,4-thiadiazol-5-yl)-1-propan-2-ylimidazolidin-2-one?
The IUPAC name of 4-hydroxy-3-(3-methyl-1,2,4-thiadiazol-5-yl)-1-propan-2-ylimidazolidin-2-one (CID 135150447) is 4-hydroxy-3-(3-methyl-1,2,4-thiadiazol-5-yl)-1-propan-2-ylimidazolidin-2-one.
What is the SMILES notation for 4-hydroxy-3-(3-methyl-1,2,4-thiadiazol-5-yl)-1-propan-2-ylimidazolidin-2-one?
The canonical SMILES for 4-hydroxy-3-(3-methyl-1,2,4-thiadiazol-5-yl)-1-propan-2-ylimidazolidin-2-one is Cc1nsc(N2C(=O)N(C(C)C)CC2O)n1.
What is the InChIKey of 4-hydroxy-3-(3-methyl-1,2,4-thiadiazol-5-yl)-1-propan-2-ylimidazolidin-2-one?
The InChIKey is ZXAGFHWCHZWRNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N4O2S/c1-5(2)12-4-7(14)13(9(12)15)8-10-6(3)11-16-8/h5,7,14H,4H2,1-3H3.
What are the key properties of 4-hydroxy-3-(3-methyl-1,2,4-thiadiazol-5-yl)-1-propan-2-ylimidazolidin-2-one?
4-hydroxy-3-(3-methyl-1,2,4-thiadiazol-5-yl)-1-propan-2-ylimidazolidin-2-one has a molecular weight of 242.30 g/mol, XLogP of 0.82, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-3-(3-methyl-1,2,4-thiadiazol-5-yl)-1-propan-2-ylimidazolidin-2-one is sourced from PubChem (CID 135150447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).