2-ethyl-3-(oxan-4-yl)-5-propylimidazolidin-4-one

C13H24N2O2 — CID 83256508

IUPAC2-ethyl-3-(oxan-4-yl)-5-propylimidazolidin-4-one
SMILESCCCC1NC(CC)N(C2CCOCC2)C1=O
InChIInChI=1S/C13H24N2O2/c1-3-5-11-13(16)15(12(4-2)14-11)10-6-8-17-9-7-10/h10-12,14H,3-9H2,1-2H3
InChIKeyWSSJXJWWHAGYHO-UHFFFAOYSA-N
MW240.35 g/mol
LogP1.50
Rot. Bonds4

About 2-ethyl-3-(oxan-4-yl)-5-propylimidazolidin-4-one

2-ethyl-3-(oxan-4-yl)-5-propylimidazolidin-4-one (PubChem CID 83256508) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is 2-ethyl-3-(oxan-4-yl)-5-propylimidazolidin-4-one.

Molecular Properties

Compound Name2-ethyl-3-(oxan-4-yl)-5-propylimidazolidin-4-one
PubChem CID83256508
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC Name2-ethyl-3-(oxan-4-yl)-5-propylimidazolidin-4-one
SMILESCCCC1NC(CC)N(C2CCOCC2)C1=O
InChIInChI=1S/C13H24N2O2/c1-3-5-11-13(16)15(12(4-2)14-11)10-6-8-17-9-7-10/h10-12,14H,3-9H2,1-2H3
InChIKeyWSSJXJWWHAGYHO-UHFFFAOYSA-N
XLogP1.50
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-cyclooctyl-2-ethyl-5-propylimidazolidin-4-one
CID 83238796
3-(oxolan-3-yl)-2,5-dipropylimidazolidin-4-one
CID 83271242
2-ethyl-5-(2-methylpropyl)-3-(oxan-4-yl)imidazolidin-4-one
CID 83255946
3-(4-ethylcyclohexyl)-2,5-dipropylimidazolidin-4-one
CID 83255938
3-(3,5-dimethylcyclohexyl)-2-ethyl-5-propylimidazolidin-4-one
CID 83259395
5-butyl-2-ethyl-3-(4-methylcyclohexyl)imidazolidin-4-one
CID 83238921
2,5-dipropyl-3-(4-propylcyclohexyl)imidazolidin-4-one
CID 83252923
3-(oxan-4-yl)-5-propan-2-yl-2-propylimidazolidin-4-one
CID 83256757
5-butyl-2-ethyl-3-(4-hydroxycyclohexyl)imidazolidin-4-one
CID 83239492
2-(5-methylthiophen-2-yl)-3-(oxan-4-yl)-5-propylimidazolidin-4-one
CID 83245482
2-ethyl-3-(2-methylcycloheptyl)-5-propylimidazolidin-4-one
CID 83258935
2-ethyl-3-methyl-5-propylimidazolidin-4-one
CID 83261092

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-3-(oxan-4-yl)-5-propylimidazolidin-4-one?
The IUPAC name of 2-ethyl-3-(oxan-4-yl)-5-propylimidazolidin-4-one (CID 83256508) is 2-ethyl-3-(oxan-4-yl)-5-propylimidazolidin-4-one.
What is the SMILES notation for 2-ethyl-3-(oxan-4-yl)-5-propylimidazolidin-4-one?
The canonical SMILES for 2-ethyl-3-(oxan-4-yl)-5-propylimidazolidin-4-one is CCCC1NC(CC)N(C2CCOCC2)C1=O.
What is the InChIKey of 2-ethyl-3-(oxan-4-yl)-5-propylimidazolidin-4-one?
The InChIKey is WSSJXJWWHAGYHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2/c1-3-5-11-13(16)15(12(4-2)14-11)10-6-8-17-9-7-10/h10-12,14H,3-9H2,1-2H3.
What are the key properties of 2-ethyl-3-(oxan-4-yl)-5-propylimidazolidin-4-one?
2-ethyl-3-(oxan-4-yl)-5-propylimidazolidin-4-one has a molecular weight of 240.35 g/mol, XLogP of 1.50, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-3-(oxan-4-yl)-5-propylimidazolidin-4-one is sourced from PubChem (CID 83256508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).