3-(2-cyclohexylethyl)-5-ethyl-2-thiophen-2-ylimidazolidin-4-one

C17H26N2OS — CID 83246276

IUPAC3-(2-cyclohexylethyl)-5-ethyl-2-thiophen-2-ylimidazolidin-4-one
SMILESCCC1NC(c2cccs2)N(CCC2CCCCC2)C1=O
InChIInChI=1S/C17H26N2OS/c1-2-14-17(20)19(11-10-13-7-4-3-5-8-13)16(18-14)15-9-6-12-21-15/h6,9,12-14,16,18H,2-5,7-8,10-11H2,1H3
InChIKeyLXTRQHFYPQVDSW-UHFFFAOYSA-N
MW306.47 g/mol
LogP3.93
Rot. Bonds5

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

3-(2-cyclohexylethyl)-5-ethyl-2-thiophen-2-ylimidazolidin-4-one (PubChem CID 83246276) has the molecular formula C17H26N2OS and a molecular weight of 306.47 g/mol. Its IUPAC name is 3-(2-cyclohexylethyl)-5-ethyl-2-thiophen-2-ylimidazolidin-4-one.

Molecular Properties

Compound Name3-(2-cyclohexylethyl)-5-ethyl-2-thiophen-2-ylimidazolidin-4-one
PubChem CID83246276
Molecular FormulaC17H26N2OS
Molecular Weight306.47 g/mol
Exact Mass306.18
IUPAC Name3-(2-cyclohexylethyl)-5-ethyl-2-thiophen-2-ylimidazolidin-4-one
SMILESCCC1NC(c2cccs2)N(CCC2CCCCC2)C1=O
InChIInChI=1S/C17H26N2OS/c1-2-14-17(20)19(11-10-13-7-4-3-5-8-13)16(18-14)15-9-6-12-21-15/h6,9,12-14,16,18H,2-5,7-8,10-11H2,1H3
InChIKeyLXTRQHFYPQVDSW-UHFFFAOYSA-N
XLogP3.93
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.47
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(2-cyclohexylethyl)-5-methyl-2-thiophen-2-ylimidazolidin-4-one
CID 83256694
3-(3-cyclopentylpropyl)-5-methyl-2-thiophen-2-ylimidazolidin-4-one
CID 106011241
5-ethyl-3-(thian-2-ylmethyl)-2-thiophen-2-ylimidazolidin-4-one
CID 83270283
5-ethyl-3-(4-methylpentyl)-2-thiophen-2-ylimidazolidin-4-one
CID 83255454
3-(2-cyclohexylethyl)-2-thiophen-2-ylimidazolidin-4-one
CID 83256115
3-[4-(dimethylamino)butyl]-5-ethyl-2-thiophen-2-ylimidazolidin-4-one
CID 83246154
5-ethyl-3-(2-ethylcyclohexyl)-2-thiophen-2-ylimidazolidin-4-one
CID 83253806
3-[[1-(dimethylamino)cyclobutyl]methyl]-5-ethyl-2-thiophen-2-ylimidazolidin-4-one
CID 105421093
5-butyl-3-pentyl-2-thiophen-2-ylimidazolidin-4-one
CID 83243552
5-ethyl-3-(2-methyl-2-methylsulfonylpropyl)-2-thiophen-2-ylimidazolidin-4-one
CID 83269104
2-cyclopentyl-3-(2-cyclopentylethyl)-5-ethylimidazolidin-4-one
CID 83255960
3-hexyl-5-propyl-2-thiophen-2-ylimidazolidin-4-one
CID 83262811

Frequently Asked Questions

What is the IUPAC name of 3-(2-cyclohexylethyl)-5-ethyl-2-thiophen-2-ylimidazolidin-4-one?
The IUPAC name of 3-(2-cyclohexylethyl)-5-ethyl-2-thiophen-2-ylimidazolidin-4-one (CID 83246276) is 3-(2-cyclohexylethyl)-5-ethyl-2-thiophen-2-ylimidazolidin-4-one.
What is the SMILES notation for 3-(2-cyclohexylethyl)-5-ethyl-2-thiophen-2-ylimidazolidin-4-one?
The canonical SMILES for 3-(2-cyclohexylethyl)-5-ethyl-2-thiophen-2-ylimidazolidin-4-one is CCC1NC(c2cccs2)N(CCC2CCCCC2)C1=O.
What is the InChIKey of 3-(2-cyclohexylethyl)-5-ethyl-2-thiophen-2-ylimidazolidin-4-one?
The InChIKey is LXTRQHFYPQVDSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2OS/c1-2-14-17(20)19(11-10-13-7-4-3-5-8-13)16(18-14)15-9-6-12-21-15/h6,9,12-14,16,18H,2-5,7-8,10-11H2,1H3.
What are the key properties of 3-(2-cyclohexylethyl)-5-ethyl-2-thiophen-2-ylimidazolidin-4-one?
3-(2-cyclohexylethyl)-5-ethyl-2-thiophen-2-ylimidazolidin-4-one has a molecular weight of 306.47 g/mol, XLogP of 3.93, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-cyclohexylethyl)-5-ethyl-2-thiophen-2-ylimidazolidin-4-one is sourced from PubChem (CID 83246276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).