3-[2-(2-methoxyethoxy)ethyl]-2-(2-methylpropyl)-5-propan-2-ylimidazolidin-4-one

C15H30N2O3 — CID 83255782

IUPAC3-[2-(2-methoxyethoxy)ethyl]-2-(2-methylpropyl)-5-propan-2-ylimidazolidin-4-one
SMILESCOCCOCCN1C(=O)C(C(C)C)NC1CC(C)C
InChIInChI=1S/C15H30N2O3/c1-11(2)10-13-16-14(12(3)4)15(18)17(13)6-7-20-9-8-19-5/h11-14,16H,6-10H2,1-5H3
InChIKeyPXKTWYBCTHIDQY-UHFFFAOYSA-N
MW286.42 g/mol
LogP1.48
Rot. Bonds9

About 3-[2-(2-methoxyethoxy)ethyl]-2-(2-methylpropyl)-5-propan-2-ylimidazolidin-4-one

3-[2-(2-methoxyethoxy)ethyl]-2-(2-methylpropyl)-5-propan-2-ylimidazolidin-4-one (PubChem CID 83255782) has the molecular formula C15H30N2O3 and a molecular weight of 286.42 g/mol. Its IUPAC name is 3-[2-(2-methoxyethoxy)ethyl]-2-(2-methylpropyl)-5-propan-2-ylimidazolidin-4-one.

Molecular Properties

Compound Name3-[2-(2-methoxyethoxy)ethyl]-2-(2-methylpropyl)-5-propan-2-ylimidazolidin-4-one
PubChem CID83255782
Molecular FormulaC15H30N2O3
Molecular Weight286.42 g/mol
Exact Mass286.23
IUPAC Name3-[2-(2-methoxyethoxy)ethyl]-2-(2-methylpropyl)-5-propan-2-ylimidazolidin-4-one
SMILESCOCCOCCN1C(=O)C(C(C)C)NC1CC(C)C
InChIInChI=1S/C15H30N2O3/c1-11(2)10-13-16-14(12(3)4)15(18)17(13)6-7-20-9-8-19-5/h11-14,16H,6-10H2,1-5H3
InChIKeyPXKTWYBCTHIDQY-UHFFFAOYSA-N
XLogP1.48
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.42
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

5-butan-2-yl-2-ethyl-3-[2-(2-methoxyethoxy)ethyl]imidazolidin-4-one
CID 83245523
3-(4-methylpentyl)-2-(2-methylpropyl)-5-propan-2-ylimidazolidin-4-one
CID 83254785
1-(2-methoxyethyl)-6-(2-methylpropyl)-3-propan-2-ylpiperazine-2,5-dione
CID 64873401
3-(2-butoxyethyl)-2-ethyl-5-propan-2-ylimidazolidin-4-one
CID 83253847
3-[4-(dimethylamino)butyl]-2-(2-methylpropyl)-5-propan-2-ylimidazolidin-4-one
CID 83246406
3-(2-ethoxyethyl)-5-methyl-2-(2-methylpropyl)imidazolidin-4-one
CID 83236846
1-[2-(2-methoxyethoxy)ethyl]-3-methyl-6-(2-methylpropyl)piperazine-2,5-dione
CID 64872364
2-(2-methylpropyl)-3-(3-methylsulfonylpropyl)-5-propan-2-ylimidazolidin-4-one
CID 83245286
5-ethyl-3-[2-(3-methylbutoxy)ethyl]-2-(2-methylpropyl)imidazolidin-4-one
CID 83253960
3-[2-(2-methoxyethoxy)ethyl]-5-propan-2-ylimidazolidin-4-one
CID 83245268
5-propan-2-yl-3-(2-propan-2-yloxyethyl)-2-propylimidazolidin-4-one
CID 104767674
5-butan-2-yl-2-(2-methylpropyl)-3-pentylimidazolidin-4-one
CID 83250722

Frequently Asked Questions

What is the IUPAC name of 3-[2-(2-methoxyethoxy)ethyl]-2-(2-methylpropyl)-5-propan-2-ylimidazolidin-4-one?
The IUPAC name of 3-[2-(2-methoxyethoxy)ethyl]-2-(2-methylpropyl)-5-propan-2-ylimidazolidin-4-one (CID 83255782) is 3-[2-(2-methoxyethoxy)ethyl]-2-(2-methylpropyl)-5-propan-2-ylimidazolidin-4-one.
What is the SMILES notation for 3-[2-(2-methoxyethoxy)ethyl]-2-(2-methylpropyl)-5-propan-2-ylimidazolidin-4-one?
The canonical SMILES for 3-[2-(2-methoxyethoxy)ethyl]-2-(2-methylpropyl)-5-propan-2-ylimidazolidin-4-one is COCCOCCN1C(=O)C(C(C)C)NC1CC(C)C.
What is the InChIKey of 3-[2-(2-methoxyethoxy)ethyl]-2-(2-methylpropyl)-5-propan-2-ylimidazolidin-4-one?
The InChIKey is PXKTWYBCTHIDQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O3/c1-11(2)10-13-16-14(12(3)4)15(18)17(13)6-7-20-9-8-19-5/h11-14,16H,6-10H2,1-5H3.
What are the key properties of 3-[2-(2-methoxyethoxy)ethyl]-2-(2-methylpropyl)-5-propan-2-ylimidazolidin-4-one?
3-[2-(2-methoxyethoxy)ethyl]-2-(2-methylpropyl)-5-propan-2-ylimidazolidin-4-one has a molecular weight of 286.42 g/mol, XLogP of 1.48, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(2-methoxyethoxy)ethyl]-2-(2-methylpropyl)-5-propan-2-ylimidazolidin-4-one is sourced from PubChem (CID 83255782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).