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

C15H24N2OS — CID 83255454

IUPAC5-ethyl-3-(4-methylpentyl)-2-thiophen-2-ylimidazolidin-4-one
SMILESCCC1NC(c2cccs2)N(CCCC(C)C)C1=O
InChIInChI=1S/C15H24N2OS/c1-4-12-15(18)17(9-5-7-11(2)3)14(16-12)13-8-6-10-19-13/h6,8,10-12,14,16H,4-5,7,9H2,1-3H3
InChIKeyWKDRHMXHQGVRRD-UHFFFAOYSA-N
MW280.44 g/mol
LogP3.39
Rot. Bonds6

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

5-ethyl-3-(4-methylpentyl)-2-thiophen-2-ylimidazolidin-4-one (PubChem CID 83255454) has the molecular formula C15H24N2OS and a molecular weight of 280.44 g/mol. Its IUPAC name is 5-ethyl-3-(4-methylpentyl)-2-thiophen-2-ylimidazolidin-4-one.

Molecular Properties

Compound Name5-ethyl-3-(4-methylpentyl)-2-thiophen-2-ylimidazolidin-4-one
PubChem CID83255454
Molecular FormulaC15H24N2OS
Molecular Weight280.44 g/mol
Exact Mass280.16
IUPAC Name5-ethyl-3-(4-methylpentyl)-2-thiophen-2-ylimidazolidin-4-one
SMILESCCC1NC(c2cccs2)N(CCCC(C)C)C1=O
InChIInChI=1S/C15H24N2OS/c1-4-12-15(18)17(9-5-7-11(2)3)14(16-12)13-8-6-10-19-13/h6,8,10-12,14,16H,4-5,7,9H2,1-3H3
InChIKeyWKDRHMXHQGVRRD-UHFFFAOYSA-N
XLogP3.39
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.44
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-butyl-3-(3-methylbutyl)-2-thiophen-2-ylimidazolidin-4-one
CID 83237065
3-[4-(dimethylamino)butyl]-5-ethyl-2-thiophen-2-ylimidazolidin-4-one
CID 83246154
5-ethyl-3-(4-methylpentyl)-2-(5-methylthiophen-2-yl)imidazolidin-4-one
CID 83257006
5-butyl-3-pentyl-2-thiophen-2-ylimidazolidin-4-one
CID 83243552
3-hexyl-5-propyl-2-thiophen-2-ylimidazolidin-4-one
CID 83262811
3-(2-cyclohexylethyl)-5-ethyl-2-thiophen-2-ylimidazolidin-4-one
CID 83246276
3-(2-methoxyethyl)-5-(2-methylpropyl)-2-thiophen-2-ylimidazolidin-4-one
CID 83242785
5-ethyl-3-(2-methyl-2-methylsulfonylpropyl)-2-thiophen-2-ylimidazolidin-4-one
CID 83269104
3-[1-(diethylamino)propan-2-yl]-5-ethyl-2-thiophen-2-ylimidazolidin-4-one
CID 83252436
5-butan-2-yl-3-pentyl-2-thiophen-2-ylimidazolidin-4-one
CID 83250979
5-methyl-3-pentyl-2-thiophen-2-ylimidazolidin-4-one
CID 83244038
3-(5-methylhexyl)-2-thiophen-2-ylimidazolidin-4-one
CID 83260430

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-3-(4-methylpentyl)-2-thiophen-2-ylimidazolidin-4-one?
The IUPAC name of 5-ethyl-3-(4-methylpentyl)-2-thiophen-2-ylimidazolidin-4-one (CID 83255454) is 5-ethyl-3-(4-methylpentyl)-2-thiophen-2-ylimidazolidin-4-one.
What is the SMILES notation for 5-ethyl-3-(4-methylpentyl)-2-thiophen-2-ylimidazolidin-4-one?
The canonical SMILES for 5-ethyl-3-(4-methylpentyl)-2-thiophen-2-ylimidazolidin-4-one is CCC1NC(c2cccs2)N(CCCC(C)C)C1=O.
What is the InChIKey of 5-ethyl-3-(4-methylpentyl)-2-thiophen-2-ylimidazolidin-4-one?
The InChIKey is WKDRHMXHQGVRRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2OS/c1-4-12-15(18)17(9-5-7-11(2)3)14(16-12)13-8-6-10-19-13/h6,8,10-12,14,16H,4-5,7,9H2,1-3H3.
What are the key properties of 5-ethyl-3-(4-methylpentyl)-2-thiophen-2-ylimidazolidin-4-one?
5-ethyl-3-(4-methylpentyl)-2-thiophen-2-ylimidazolidin-4-one has a molecular weight of 280.44 g/mol, XLogP of 3.39, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-3-(4-methylpentyl)-2-thiophen-2-ylimidazolidin-4-one is sourced from PubChem (CID 83255454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).