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

C11H22N2O3 — CID 83245268

IUPAC3-[2-(2-methoxyethoxy)ethyl]-5-propan-2-ylimidazolidin-4-one
SMILESCOCCOCCN1CNC(C(C)C)C1=O
InChIInChI=1S/C11H22N2O3/c1-9(2)10-11(14)13(8-12-10)4-5-16-7-6-15-3/h9-10,12H,4-8H2,1-3H3
InChIKeyKWGZLEPQQSVLBT-UHFFFAOYSA-N
MW230.31 g/mol
LogP0.06
Rot. Bonds7

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

3-[2-(2-methoxyethoxy)ethyl]-5-propan-2-ylimidazolidin-4-one (PubChem CID 83245268) has the molecular formula C11H22N2O3 and a molecular weight of 230.31 g/mol. Its IUPAC name is 3-[2-(2-methoxyethoxy)ethyl]-5-propan-2-ylimidazolidin-4-one.

Molecular Properties

Compound Name3-[2-(2-methoxyethoxy)ethyl]-5-propan-2-ylimidazolidin-4-one
PubChem CID83245268
Molecular FormulaC11H22N2O3
Molecular Weight230.31 g/mol
Exact Mass230.16
IUPAC Name3-[2-(2-methoxyethoxy)ethyl]-5-propan-2-ylimidazolidin-4-one
SMILESCOCCOCCN1CNC(C(C)C)C1=O
InChIInChI=1S/C11H22N2O3/c1-9(2)10-11(14)13(8-12-10)4-5-16-7-6-15-3/h9-10,12H,4-8H2,1-3H3
InChIKeyKWGZLEPQQSVLBT-UHFFFAOYSA-N
XLogP0.06
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 50.06
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

3-[2-(2-methoxyethoxy)ethyl]-5-methylimidazolidin-4-one
CID 83256580
3-(2-cyclohexyloxyethyl)-5-propan-2-ylimidazolidin-4-one
CID 83263545
1-[2-(3-methoxypropoxy)ethyl]-3-propan-2-ylpiperazine-2,5-dione
CID 103184685
3-hexyl-5-propan-2-ylimidazolidin-4-one
CID 83263616
3-(4-methylpentyl)-5-propan-2-ylimidazolidin-4-one
CID 83257837
3-(2-cyclopropylethyl)-5-propan-2-ylimidazolidin-4-one
CID 83258288
3-[2-(diethylamino)ethyl]-5-propan-2-ylimidazolidin-4-one
CID 83240107
1-[2-(2-methoxyethoxy)ethyl]-3-methylpiperazine-2,5-dione
CID 64880925
1-(3-methoxypropyl)-3-propan-2-yl-1,4-diazepane-2,5-dione
CID 64884105
3-[2-(2-methoxyethoxy)ethyl]-2-(2-methylpropyl)-5-propan-2-ylimidazolidin-4-one
CID 83255782
5-ethyl-3-(2-methoxyethyl)imidazolidin-4-one
CID 83242628
5-propan-2-yl-3-(2,3,3-trimethylbutyl)imidazolidin-4-one
CID 83259518

Frequently Asked Questions

What is the IUPAC name of 3-[2-(2-methoxyethoxy)ethyl]-5-propan-2-ylimidazolidin-4-one?
The IUPAC name of 3-[2-(2-methoxyethoxy)ethyl]-5-propan-2-ylimidazolidin-4-one (CID 83245268) is 3-[2-(2-methoxyethoxy)ethyl]-5-propan-2-ylimidazolidin-4-one.
What is the SMILES notation for 3-[2-(2-methoxyethoxy)ethyl]-5-propan-2-ylimidazolidin-4-one?
The canonical SMILES for 3-[2-(2-methoxyethoxy)ethyl]-5-propan-2-ylimidazolidin-4-one is COCCOCCN1CNC(C(C)C)C1=O.
What is the InChIKey of 3-[2-(2-methoxyethoxy)ethyl]-5-propan-2-ylimidazolidin-4-one?
The InChIKey is KWGZLEPQQSVLBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O3/c1-9(2)10-11(14)13(8-12-10)4-5-16-7-6-15-3/h9-10,12H,4-8H2,1-3H3.
What are the key properties of 3-[2-(2-methoxyethoxy)ethyl]-5-propan-2-ylimidazolidin-4-one?
3-[2-(2-methoxyethoxy)ethyl]-5-propan-2-ylimidazolidin-4-one has a molecular weight of 230.31 g/mol, XLogP of 0.06, 7 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]-5-propan-2-ylimidazolidin-4-one is sourced from PubChem (CID 83245268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).