3,5-dimethyl-2-thiophen-3-ylimidazolidin-4-one

C9H12N2OS — CID 83260781

IUPAC3,5-dimethyl-2-thiophen-3-ylimidazolidin-4-one
SMILESCC1NC(c2ccsc2)N(C)C1=O
InChIInChI=1S/C9H12N2OS/c1-6-9(12)11(2)8(10-6)7-3-4-13-5-7/h3-6,8,10H,1-2H3
InChIKeyAMIPUHONAAYHHB-UHFFFAOYSA-N
MW196.27 g/mol
LogP1.20
Rot. Bonds1

About 3,5-dimethyl-2-thiophen-3-ylimidazolidin-4-one

3,5-dimethyl-2-thiophen-3-ylimidazolidin-4-one (PubChem CID 83260781) has the molecular formula C9H12N2OS and a molecular weight of 196.27 g/mol. Its IUPAC name is 3,5-dimethyl-2-thiophen-3-ylimidazolidin-4-one.

Molecular Properties

Compound Name3,5-dimethyl-2-thiophen-3-ylimidazolidin-4-one
PubChem CID83260781
Molecular FormulaC9H12N2OS
Molecular Weight196.27 g/mol
Exact Mass196.07
IUPAC Name3,5-dimethyl-2-thiophen-3-ylimidazolidin-4-one
SMILESCC1NC(c2ccsc2)N(C)C1=O
InChIInChI=1S/C9H12N2OS/c1-6-9(12)11(2)8(10-6)7-3-4-13-5-7/h3-6,8,10H,1-2H3
InChIKeyAMIPUHONAAYHHB-UHFFFAOYSA-N
XLogP1.20
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.27
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-methyl-3-(1-methylpiperidin-4-yl)-2-thiophen-3-ylimidazolidin-4-one
CID 83243425
5-methyl-2-thiophen-3-yl-3-(2,2,2-trifluoroethyl)imidazolidin-4-one
CID 113225393
5-methyl-3-[(1-methylcyclobutyl)methyl]-2-thiophen-3-ylimidazolidin-4-one
CID 114109735
5-methyl-3-(2-pyrrolidin-1-ylethyl)-2-thiophen-3-ylimidazolidin-4-one
CID 83251904
5-methyl-3-(2-piperidin-1-ylethyl)-2-thiophen-3-ylimidazolidin-4-one
CID 83245085
3,5-dimethyl-2-(4-methylphenyl)imidazolidin-4-one
CID 83260782
5-methyl-2-thiophen-3-yl-3-(5,5,5-trifluoropentyl)imidazolidin-4-one
CID 83259776
5-methyl-3-[2-(1-methylpiperidin-4-yl)ethyl]-2-thiophen-3-ylimidazolidin-4-one
CID 114517110
5-methyl-3-(1-methylpiperidin-3-yl)-2-thiophen-3-ylimidazolidin-4-one
CID 83255677
3-(1,3-dimethylpiperidin-4-yl)-5-methyl-2-thiophen-3-ylimidazolidin-4-one
CID 114506900
3-(2-cyclohexyloxyethyl)-5-methyl-2-thiophen-3-ylimidazolidin-4-one
CID 83262920
3-(3-ethyl-2-methylcyclopentyl)-5-methyl-2-thiophen-3-ylimidazolidin-4-one
CID 83259456

Frequently Asked Questions

What is the IUPAC name of 3,5-dimethyl-2-thiophen-3-ylimidazolidin-4-one?
The IUPAC name of 3,5-dimethyl-2-thiophen-3-ylimidazolidin-4-one (CID 83260781) is 3,5-dimethyl-2-thiophen-3-ylimidazolidin-4-one.
What is the SMILES notation for 3,5-dimethyl-2-thiophen-3-ylimidazolidin-4-one?
The canonical SMILES for 3,5-dimethyl-2-thiophen-3-ylimidazolidin-4-one is CC1NC(c2ccsc2)N(C)C1=O.
What is the InChIKey of 3,5-dimethyl-2-thiophen-3-ylimidazolidin-4-one?
The InChIKey is AMIPUHONAAYHHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2OS/c1-6-9(12)11(2)8(10-6)7-3-4-13-5-7/h3-6,8,10H,1-2H3.
What are the key properties of 3,5-dimethyl-2-thiophen-3-ylimidazolidin-4-one?
3,5-dimethyl-2-thiophen-3-ylimidazolidin-4-one has a molecular weight of 196.27 g/mol, XLogP of 1.20, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethyl-2-thiophen-3-ylimidazolidin-4-one is sourced from PubChem (CID 83260781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).