3-(2-butoxyethyl)-2-ethyl-5-propan-2-ylimidazolidin-4-one

C14H28N2O2 — CID 83253847

IUPAC3-(2-butoxyethyl)-2-ethyl-5-propan-2-ylimidazolidin-4-one
SMILESCCCCOCCN1C(=O)C(C(C)C)NC1CC
InChIInChI=1S/C14H28N2O2/c1-5-7-9-18-10-8-16-12(6-2)15-13(11(3)4)14(16)17/h11-13,15H,5-10H2,1-4H3
InChIKeyUJLHZWLREQOBTA-UHFFFAOYSA-N
MW256.39 g/mol
LogP2.00
Rot. Bonds8

About 3-(2-butoxyethyl)-2-ethyl-5-propan-2-ylimidazolidin-4-one

3-(2-butoxyethyl)-2-ethyl-5-propan-2-ylimidazolidin-4-one (PubChem CID 83253847) has the molecular formula C14H28N2O2 and a molecular weight of 256.39 g/mol. Its IUPAC name is 3-(2-butoxyethyl)-2-ethyl-5-propan-2-ylimidazolidin-4-one.

Molecular Properties

Compound Name3-(2-butoxyethyl)-2-ethyl-5-propan-2-ylimidazolidin-4-one
PubChem CID83253847
Molecular FormulaC14H28N2O2
Molecular Weight256.39 g/mol
Exact Mass256.22
IUPAC Name3-(2-butoxyethyl)-2-ethyl-5-propan-2-ylimidazolidin-4-one
SMILESCCCCOCCN1C(=O)C(C(C)C)NC1CC
InChIInChI=1S/C14H28N2O2/c1-5-7-9-18-10-8-16-12(6-2)15-13(11(3)4)14(16)17/h11-13,15H,5-10H2,1-4H3
InChIKeyUJLHZWLREQOBTA-UHFFFAOYSA-N
XLogP2.00
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-ethyl-3-pentyl-5-propan-2-ylimidazolidin-4-one
CID 83250549
1-(2-butoxyethyl)-6-methyl-3-propan-2-ylpiperazine-2,5-dione
CID 64873847
5-butan-2-yl-2-ethyl-3-[2-(2-methoxyethoxy)ethyl]imidazolidin-4-one
CID 83245523
3-[2-(2-methoxyethoxy)ethyl]-2-(2-methylpropyl)-5-propan-2-ylimidazolidin-4-one
CID 83255782
2-ethyl-3-[2-(4-methylcyclohexyl)ethyl]-5-propan-2-ylimidazolidin-4-one
CID 83263281
5-propan-2-yl-3-(2-propan-2-yloxyethyl)-2-propylimidazolidin-4-one
CID 104767674
3-butan-2-yl-1-(2-butoxyethyl)-6-ethylpiperazine-2,5-dione
CID 64902153
3-(2-butoxyethyl)-5-(2-methylpropyl)-2-propylimidazolidin-4-one
CID 83253671
2-ethyl-5-(2-methylpropyl)-3-(3-propoxypropyl)imidazolidin-4-one
CID 83260824
3-(cyclobutylmethyl)-2-ethyl-5-propan-2-ylimidazolidin-4-one
CID 83243656
2-ethyl-3-[2-(oxolan-2-yl)ethyl]-5-propan-2-ylimidazolidin-4-one
CID 83249092
3-butyl-2,5-di(propan-2-yl)imidazolidin-4-one
CID 83238523

Frequently Asked Questions

What is the IUPAC name of 3-(2-butoxyethyl)-2-ethyl-5-propan-2-ylimidazolidin-4-one?
The IUPAC name of 3-(2-butoxyethyl)-2-ethyl-5-propan-2-ylimidazolidin-4-one (CID 83253847) is 3-(2-butoxyethyl)-2-ethyl-5-propan-2-ylimidazolidin-4-one.
What is the SMILES notation for 3-(2-butoxyethyl)-2-ethyl-5-propan-2-ylimidazolidin-4-one?
The canonical SMILES for 3-(2-butoxyethyl)-2-ethyl-5-propan-2-ylimidazolidin-4-one is CCCCOCCN1C(=O)C(C(C)C)NC1CC.
What is the InChIKey of 3-(2-butoxyethyl)-2-ethyl-5-propan-2-ylimidazolidin-4-one?
The InChIKey is UJLHZWLREQOBTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O2/c1-5-7-9-18-10-8-16-12(6-2)15-13(11(3)4)14(16)17/h11-13,15H,5-10H2,1-4H3.
What are the key properties of 3-(2-butoxyethyl)-2-ethyl-5-propan-2-ylimidazolidin-4-one?
3-(2-butoxyethyl)-2-ethyl-5-propan-2-ylimidazolidin-4-one has a molecular weight of 256.39 g/mol, XLogP of 2.00, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-butoxyethyl)-2-ethyl-5-propan-2-ylimidazolidin-4-one is sourced from PubChem (CID 83253847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).