3-(2-methoxyethyl)-5-(2-methylpropyl)-2-thiophen-2-ylimidazolidin-4-one

C14H22N2O2S — CID 83242785

IUPAC3-(2-methoxyethyl)-5-(2-methylpropyl)-2-thiophen-2-ylimidazolidin-4-one
SMILESCOCCN1C(=O)C(CC(C)C)NC1c1cccs1
InChIInChI=1S/C14H22N2O2S/c1-10(2)9-11-14(17)16(6-7-18-3)13(15-11)12-5-4-8-19-12/h4-5,8,10-11,13,15H,6-7,9H2,1-3H3
InChIKeyDSCJMTJJFGRUFI-UHFFFAOYSA-N
MW282.41 g/mol
LogP2.24
Rot. Bonds6

About 3-(2-methoxyethyl)-5-(2-methylpropyl)-2-thiophen-2-ylimidazolidin-4-one

3-(2-methoxyethyl)-5-(2-methylpropyl)-2-thiophen-2-ylimidazolidin-4-one (PubChem CID 83242785) has the molecular formula C14H22N2O2S and a molecular weight of 282.41 g/mol. Its IUPAC name is 3-(2-methoxyethyl)-5-(2-methylpropyl)-2-thiophen-2-ylimidazolidin-4-one.

Molecular Properties

Compound Name3-(2-methoxyethyl)-5-(2-methylpropyl)-2-thiophen-2-ylimidazolidin-4-one
PubChem CID83242785
Molecular FormulaC14H22N2O2S
Molecular Weight282.41 g/mol
Exact Mass282.14
IUPAC Name3-(2-methoxyethyl)-5-(2-methylpropyl)-2-thiophen-2-ylimidazolidin-4-one
SMILESCOCCN1C(=O)C(CC(C)C)NC1c1cccs1
InChIInChI=1S/C14H22N2O2S/c1-10(2)9-11-14(17)16(6-7-18-3)13(15-11)12-5-4-8-19-12/h4-5,8,10-11,13,15H,6-7,9H2,1-3H3
InChIKeyDSCJMTJJFGRUFI-UHFFFAOYSA-N
XLogP2.24
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.41
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(2-methoxyethyl)-2-(2-methylphenyl)-5-(2-methylpropyl)imidazolidin-4-one
CID 83247251
5-ethyl-3-(4-methylpentyl)-2-thiophen-2-ylimidazolidin-4-one
CID 83255454
5-butyl-3-(3-methylbutyl)-2-thiophen-2-ylimidazolidin-4-one
CID 83237065
methyl 3-(5-oxo-4-propyl-2-thiophen-2-ylimidazolidin-1-yl)propanoate
CID 83256806
5-butan-2-yl-3-(2-propan-2-yloxyethyl)-2-thiophen-2-ylimidazolidin-4-one
CID 104767703
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-(1-methoxypropan-2-yl)-5-propyl-2-thiophen-2-ylimidazolidin-4-one
CID 83239793
3-(2-methylsulfonylethyl)-5-propyl-2-thiophen-2-ylimidazolidin-4-one
CID 83255729
3-[4-(dimethylamino)butyl]-5-ethyl-2-thiophen-2-ylimidazolidin-4-one
CID 83246154
3-(2-cyclohexylethyl)-5-ethyl-2-thiophen-2-ylimidazolidin-4-one
CID 83246276
3-ethyl-5-propan-2-yl-2-thiophen-2-ylimidazolidin-4-one
CID 83239257

Frequently Asked Questions

What is the IUPAC name of 3-(2-methoxyethyl)-5-(2-methylpropyl)-2-thiophen-2-ylimidazolidin-4-one?
The IUPAC name of 3-(2-methoxyethyl)-5-(2-methylpropyl)-2-thiophen-2-ylimidazolidin-4-one (CID 83242785) is 3-(2-methoxyethyl)-5-(2-methylpropyl)-2-thiophen-2-ylimidazolidin-4-one.
What is the SMILES notation for 3-(2-methoxyethyl)-5-(2-methylpropyl)-2-thiophen-2-ylimidazolidin-4-one?
The canonical SMILES for 3-(2-methoxyethyl)-5-(2-methylpropyl)-2-thiophen-2-ylimidazolidin-4-one is COCCN1C(=O)C(CC(C)C)NC1c1cccs1.
What is the InChIKey of 3-(2-methoxyethyl)-5-(2-methylpropyl)-2-thiophen-2-ylimidazolidin-4-one?
The InChIKey is DSCJMTJJFGRUFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2S/c1-10(2)9-11-14(17)16(6-7-18-3)13(15-11)12-5-4-8-19-12/h4-5,8,10-11,13,15H,6-7,9H2,1-3H3.
What are the key properties of 3-(2-methoxyethyl)-5-(2-methylpropyl)-2-thiophen-2-ylimidazolidin-4-one?
3-(2-methoxyethyl)-5-(2-methylpropyl)-2-thiophen-2-ylimidazolidin-4-one has a molecular weight of 282.41 g/mol, XLogP of 2.24, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methoxyethyl)-5-(2-methylpropyl)-2-thiophen-2-ylimidazolidin-4-one is sourced from PubChem (CID 83242785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).