3-[2-(2-methoxyethoxy)ethyl]-2-propylimidazolidin-4-one

C11H22N2O3 — CID 83255942

IUPAC3-[2-(2-methoxyethoxy)ethyl]-2-propylimidazolidin-4-one
SMILESCCCC1NCC(=O)N1CCOCCOC
InChIInChI=1S/C11H22N2O3/c1-3-4-10-12-9-11(14)13(10)5-6-16-8-7-15-2/h10,12H,3-9H2,1-2H3
InChIKeyJXYWHGXCPCYQQK-UHFFFAOYSA-N
MW230.31 g/mol
LogP0.21
Rot. Bonds8

About 3-[2-(2-methoxyethoxy)ethyl]-2-propylimidazolidin-4-one

3-[2-(2-methoxyethoxy)ethyl]-2-propylimidazolidin-4-one (PubChem CID 83255942) has the molecular formula C11H22N2O3 and a molecular weight of 230.31 g/mol. Its IUPAC name is 3-[2-(2-methoxyethoxy)ethyl]-2-propylimidazolidin-4-one.

Molecular Properties

Compound Name3-[2-(2-methoxyethoxy)ethyl]-2-propylimidazolidin-4-one
PubChem CID83255942
Molecular FormulaC11H22N2O3
Molecular Weight230.31 g/mol
Exact Mass230.16
IUPAC Name3-[2-(2-methoxyethoxy)ethyl]-2-propylimidazolidin-4-one
SMILESCCCC1NCC(=O)N1CCOCCOC
InChIInChI=1S/C11H22N2O3/c1-3-4-10-12-9-11(14)13(10)5-6-16-8-7-15-2/h10,12H,3-9H2,1-2H3
InChIKeyJXYWHGXCPCYQQK-UHFFFAOYSA-N
XLogP0.21
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 50.21
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-cyclohexyloxyethyl)-2-propylimidazolidin-4-one
CID 83264060
3-(2-methylsulfanylethyl)-2-propylimidazolidin-4-one
CID 83257532
3-(2-methylsulfonylethyl)-2-propylimidazolidin-4-one
CID 83255892
3-methyl-2-propylimidazolidin-4-one
CID 83259789
3-(2-methylpropyl)-2-propylimidazolidin-4-one
CID 83242214
3-(2-butoxyethyl)-2-methylimidazolidin-4-one
CID 83254187
3-(4-methoxybutan-2-yl)-2-propylimidazolidin-4-one
CID 83259409
3-(1-methoxypentan-2-yl)-2-propylimidazolidin-4-one
CID 83263990
3-[(1-methylpiperidin-2-yl)methyl]-2-propylimidazolidin-4-one
CID 83247955
3-(3-ethoxypropyl)-2-ethylimidazolidin-4-one
CID 83236752
3-ethyl-1-[2-(3-methoxypropoxy)ethyl]-6-propylpiperazine-2,5-dione
CID 103184655
3-butyl-2-ethylimidazolidin-4-one
CID 83238160

Frequently Asked Questions

What is the IUPAC name of 3-[2-(2-methoxyethoxy)ethyl]-2-propylimidazolidin-4-one?
The IUPAC name of 3-[2-(2-methoxyethoxy)ethyl]-2-propylimidazolidin-4-one (CID 83255942) is 3-[2-(2-methoxyethoxy)ethyl]-2-propylimidazolidin-4-one.
What is the SMILES notation for 3-[2-(2-methoxyethoxy)ethyl]-2-propylimidazolidin-4-one?
The canonical SMILES for 3-[2-(2-methoxyethoxy)ethyl]-2-propylimidazolidin-4-one is CCCC1NCC(=O)N1CCOCCOC.
What is the InChIKey of 3-[2-(2-methoxyethoxy)ethyl]-2-propylimidazolidin-4-one?
The InChIKey is JXYWHGXCPCYQQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O3/c1-3-4-10-12-9-11(14)13(10)5-6-16-8-7-15-2/h10,12H,3-9H2,1-2H3.
What are the key properties of 3-[2-(2-methoxyethoxy)ethyl]-2-propylimidazolidin-4-one?
3-[2-(2-methoxyethoxy)ethyl]-2-propylimidazolidin-4-one has a molecular weight of 230.31 g/mol, XLogP of 0.21, 8 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-propylimidazolidin-4-one is sourced from PubChem (CID 83255942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).