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

C16H24N2OS — CID 83239488

IUPAC5-ethyl-3-(4-methylcyclohexyl)-2-thiophen-2-ylimidazolidin-4-one
SMILESCCC1NC(c2cccs2)N(C2CCC(C)CC2)C1=O
InChIInChI=1S/C16H24N2OS/c1-3-13-16(19)18(12-8-6-11(2)7-9-12)15(17-13)14-5-4-10-20-14/h4-5,10-13,15,17H,3,6-9H2,1-2H3
InChIKeySAQXTDGWJRAKNM-UHFFFAOYSA-N
MW292.45 g/mol
LogP3.54
Rot. Bonds3

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

5-ethyl-3-(4-methylcyclohexyl)-2-thiophen-2-ylimidazolidin-4-one (PubChem CID 83239488) has the molecular formula C16H24N2OS and a molecular weight of 292.45 g/mol. Its IUPAC name is 5-ethyl-3-(4-methylcyclohexyl)-2-thiophen-2-ylimidazolidin-4-one.

Molecular Properties

Compound Name5-ethyl-3-(4-methylcyclohexyl)-2-thiophen-2-ylimidazolidin-4-one
PubChem CID83239488
Molecular FormulaC16H24N2OS
Molecular Weight292.45 g/mol
Exact Mass292.16
IUPAC Name5-ethyl-3-(4-methylcyclohexyl)-2-thiophen-2-ylimidazolidin-4-one
SMILESCCC1NC(c2cccs2)N(C2CCC(C)CC2)C1=O
InChIInChI=1S/C16H24N2OS/c1-3-13-16(19)18(12-8-6-11(2)7-9-12)15(17-13)14-5-4-10-20-14/h4-5,10-13,15,17H,3,6-9H2,1-2H3
InChIKeySAQXTDGWJRAKNM-UHFFFAOYSA-N
XLogP3.54
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 ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-ethyl-3-(4-methylcyclohexyl)-2-thiophen-2-ylimidazolidin-4-one?
The IUPAC name of 5-ethyl-3-(4-methylcyclohexyl)-2-thiophen-2-ylimidazolidin-4-one (CID 83239488) is 5-ethyl-3-(4-methylcyclohexyl)-2-thiophen-2-ylimidazolidin-4-one.
What is the SMILES notation for 5-ethyl-3-(4-methylcyclohexyl)-2-thiophen-2-ylimidazolidin-4-one?
The canonical SMILES for 5-ethyl-3-(4-methylcyclohexyl)-2-thiophen-2-ylimidazolidin-4-one is CCC1NC(c2cccs2)N(C2CCC(C)CC2)C1=O.
What is the InChIKey of 5-ethyl-3-(4-methylcyclohexyl)-2-thiophen-2-ylimidazolidin-4-one?
The InChIKey is SAQXTDGWJRAKNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2OS/c1-3-13-16(19)18(12-8-6-11(2)7-9-12)15(17-13)14-5-4-10-20-14/h4-5,10-13,15,17H,3,6-9H2,1-2H3.
What are the key properties of 5-ethyl-3-(4-methylcyclohexyl)-2-thiophen-2-ylimidazolidin-4-one?
5-ethyl-3-(4-methylcyclohexyl)-2-thiophen-2-ylimidazolidin-4-one has a molecular weight of 292.45 g/mol, XLogP of 3.54, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-3-(4-methylcyclohexyl)-2-thiophen-2-ylimidazolidin-4-one is sourced from PubChem (CID 83239488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).