3-(3-ethyl-2-methylcyclopentyl)-5-methyl-2-thiophen-3-ylimidazolidin-4-one

C16H24N2OS — CID 83259456

IUPAC3-(3-ethyl-2-methylcyclopentyl)-5-methyl-2-thiophen-3-ylimidazolidin-4-one
SMILESCCC1CCC(N2C(=O)C(C)NC2c2ccsc2)C1C
InChIInChI=1S/C16H24N2OS/c1-4-12-5-6-14(10(12)2)18-15(13-7-8-20-9-13)17-11(3)16(18)19/h7-12,14-15,17H,4-6H2,1-3H3
InChIKeyJNMMRBULQBBKGA-UHFFFAOYSA-N
MW292.45 g/mol
LogP3.39
Rot. Bonds3

About 3-(3-ethyl-2-methylcyclopentyl)-5-methyl-2-thiophen-3-ylimidazolidin-4-one

3-(3-ethyl-2-methylcyclopentyl)-5-methyl-2-thiophen-3-ylimidazolidin-4-one (PubChem CID 83259456) has the molecular formula C16H24N2OS and a molecular weight of 292.45 g/mol. Its IUPAC name is 3-(3-ethyl-2-methylcyclopentyl)-5-methyl-2-thiophen-3-ylimidazolidin-4-one.

Molecular Properties

Compound Name3-(3-ethyl-2-methylcyclopentyl)-5-methyl-2-thiophen-3-ylimidazolidin-4-one
PubChem CID83259456
Molecular FormulaC16H24N2OS
Molecular Weight292.45 g/mol
Exact Mass292.16
IUPAC Name3-(3-ethyl-2-methylcyclopentyl)-5-methyl-2-thiophen-3-ylimidazolidin-4-one
SMILESCCC1CCC(N2C(=O)C(C)NC2c2ccsc2)C1C
InChIInChI=1S/C16H24N2OS/c1-4-12-5-6-14(10(12)2)18-15(13-7-8-20-9-13)17-11(3)16(18)19/h7-12,14-15,17H,4-6H2,1-3H3
InChIKeyJNMMRBULQBBKGA-UHFFFAOYSA-N
XLogP3.39
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.45
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(1,3-dimethylpiperidin-4-yl)-5-methyl-2-thiophen-3-ylimidazolidin-4-one
CID 114506900
5-methyl-3-(1-methylpiperidin-4-yl)-2-thiophen-3-ylimidazolidin-4-one
CID 83243425
5-ethyl-3-(3-ethyl-2-methylcyclopentyl)-2-thiophen-2-ylimidazolidin-4-one
CID 83266925
5-methyl-3-(1-methylpiperidin-3-yl)-2-thiophen-3-ylimidazolidin-4-one
CID 83255677
3,5-dimethyl-2-thiophen-3-ylimidazolidin-4-one
CID 83260781
5-butan-2-yl-3-cyclobutyl-2-thiophen-3-ylimidazolidin-4-one
CID 83255478
3-(2,3-dimethylcyclopentyl)-5-methyl-2-(4-methylphenyl)imidazolidin-4-one
CID 83267871
5-methyl-2-thiophen-3-yl-3-(2,2,2-trifluoroethyl)imidazolidin-4-one
CID 113225393
5-methyl-3-(2-pyrrolidin-1-ylethyl)-2-thiophen-3-ylimidazolidin-4-one
CID 83251904
3-cyclopropyl-5-(2-methylpropyl)-2-thiophen-3-ylimidazolidin-4-one
CID 83242971
5-methyl-3-[(1-methylcyclobutyl)methyl]-2-thiophen-3-ylimidazolidin-4-one
CID 114109735
5-methyl-3-[2-(1-methylpiperidin-4-yl)ethyl]-2-thiophen-3-ylimidazolidin-4-one
CID 114517110

Frequently Asked Questions

What is the IUPAC name of 3-(3-ethyl-2-methylcyclopentyl)-5-methyl-2-thiophen-3-ylimidazolidin-4-one?
The IUPAC name of 3-(3-ethyl-2-methylcyclopentyl)-5-methyl-2-thiophen-3-ylimidazolidin-4-one (CID 83259456) is 3-(3-ethyl-2-methylcyclopentyl)-5-methyl-2-thiophen-3-ylimidazolidin-4-one.
What is the SMILES notation for 3-(3-ethyl-2-methylcyclopentyl)-5-methyl-2-thiophen-3-ylimidazolidin-4-one?
The canonical SMILES for 3-(3-ethyl-2-methylcyclopentyl)-5-methyl-2-thiophen-3-ylimidazolidin-4-one is CCC1CCC(N2C(=O)C(C)NC2c2ccsc2)C1C.
What is the InChIKey of 3-(3-ethyl-2-methylcyclopentyl)-5-methyl-2-thiophen-3-ylimidazolidin-4-one?
The InChIKey is JNMMRBULQBBKGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2OS/c1-4-12-5-6-14(10(12)2)18-15(13-7-8-20-9-13)17-11(3)16(18)19/h7-12,14-15,17H,4-6H2,1-3H3.
What are the key properties of 3-(3-ethyl-2-methylcyclopentyl)-5-methyl-2-thiophen-3-ylimidazolidin-4-one?
3-(3-ethyl-2-methylcyclopentyl)-5-methyl-2-thiophen-3-ylimidazolidin-4-one has a molecular weight of 292.45 g/mol, XLogP of 3.39, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-ethyl-2-methylcyclopentyl)-5-methyl-2-thiophen-3-ylimidazolidin-4-one is sourced from PubChem (CID 83259456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).