3-(1-ethoxypropan-2-yl)-2-methyl-5-(2-methylpropyl)imidazolidin-4-one

C13H26N2O2 — CID 83246403

IUPAC3-(1-ethoxypropan-2-yl)-2-methyl-5-(2-methylpropyl)imidazolidin-4-one
SMILESCCOCC(C)N1C(=O)C(CC(C)C)NC1C
InChIInChI=1S/C13H26N2O2/c1-6-17-8-10(4)15-11(5)14-12(13(15)16)7-9(2)3/h9-12,14H,6-8H2,1-5H3
InChIKeyMLFMCPXYADAICX-UHFFFAOYSA-N
MW242.36 g/mol
LogP1.60
Rot. Bonds6

About 3-(1-ethoxypropan-2-yl)-2-methyl-5-(2-methylpropyl)imidazolidin-4-one

3-(1-ethoxypropan-2-yl)-2-methyl-5-(2-methylpropyl)imidazolidin-4-one (PubChem CID 83246403) has the molecular formula C13H26N2O2 and a molecular weight of 242.36 g/mol. Its IUPAC name is 3-(1-ethoxypropan-2-yl)-2-methyl-5-(2-methylpropyl)imidazolidin-4-one.

Molecular Properties

Compound Name3-(1-ethoxypropan-2-yl)-2-methyl-5-(2-methylpropyl)imidazolidin-4-one
PubChem CID83246403
Molecular FormulaC13H26N2O2
Molecular Weight242.36 g/mol
Exact Mass242.20
IUPAC Name3-(1-ethoxypropan-2-yl)-2-methyl-5-(2-methylpropyl)imidazolidin-4-one
SMILESCCOCC(C)N1C(=O)C(CC(C)C)NC1C
InChIInChI=1S/C13H26N2O2/c1-6-17-8-10(4)15-11(5)14-12(13(15)16)7-9(2)3/h9-12,14H,6-8H2,1-5H3
InChIKeyMLFMCPXYADAICX-UHFFFAOYSA-N
XLogP1.60
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.36
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(1-ethoxypropan-2-yl)-5-methyl-2-(2-methylpropyl)imidazolidin-4-one
CID 83246924
3-[1-(dimethylamino)propan-2-yl]-2-methyl-5-(2-methylpropyl)imidazolidin-4-one
CID 83260910
3-(3,3-dimethylbutan-2-yl)-2-methyl-5-(2-methylpropyl)imidazolidin-4-one
CID 104830803
3-(1-methoxypropan-2-yl)-2-methyl-5-propylimidazolidin-4-one
CID 83240070
5-butan-2-yl-3-(1-ethoxypropan-2-yl)-2-(2-methylpropyl)imidazolidin-4-one
CID 83245364
1-(1-ethoxypropan-2-yl)-6-methyl-3-propan-2-ylpiperazine-2,5-dione
CID 64967279
3-[1-(dimethylamino)-4-methylpentan-2-yl]-2-methyl-5-(2-methylpropyl)imidazolidin-4-one
CID 83248649
3-(1-ethoxypropan-2-yl)-5-ethyl-2-(4-methylphenyl)imidazolidin-4-one
CID 83244890
2-methyl-3-(6-methylheptan-2-yl)-5-propylimidazolidin-4-one
CID 83252812
1-(1-methoxypropan-2-yl)-6-methyl-3-(2-methylpropyl)piperazine-2,5-dione
CID 64956777
2-(4-chlorophenyl)-3-(1-ethoxypropan-2-yl)-5-ethylimidazolidin-4-one
CID 83245870
1-(1-ethoxypropan-2-yl)-6-ethyl-3-propylpiperazine-2,5-dione
CID 64967295

Frequently Asked Questions

What is the IUPAC name of 3-(1-ethoxypropan-2-yl)-2-methyl-5-(2-methylpropyl)imidazolidin-4-one?
The IUPAC name of 3-(1-ethoxypropan-2-yl)-2-methyl-5-(2-methylpropyl)imidazolidin-4-one (CID 83246403) is 3-(1-ethoxypropan-2-yl)-2-methyl-5-(2-methylpropyl)imidazolidin-4-one.
What is the SMILES notation for 3-(1-ethoxypropan-2-yl)-2-methyl-5-(2-methylpropyl)imidazolidin-4-one?
The canonical SMILES for 3-(1-ethoxypropan-2-yl)-2-methyl-5-(2-methylpropyl)imidazolidin-4-one is CCOCC(C)N1C(=O)C(CC(C)C)NC1C.
What is the InChIKey of 3-(1-ethoxypropan-2-yl)-2-methyl-5-(2-methylpropyl)imidazolidin-4-one?
The InChIKey is MLFMCPXYADAICX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O2/c1-6-17-8-10(4)15-11(5)14-12(13(15)16)7-9(2)3/h9-12,14H,6-8H2,1-5H3.
What are the key properties of 3-(1-ethoxypropan-2-yl)-2-methyl-5-(2-methylpropyl)imidazolidin-4-one?
3-(1-ethoxypropan-2-yl)-2-methyl-5-(2-methylpropyl)imidazolidin-4-one has a molecular weight of 242.36 g/mol, XLogP of 1.60, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-ethoxypropan-2-yl)-2-methyl-5-(2-methylpropyl)imidazolidin-4-one is sourced from PubChem (CID 83246403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).