3-(1-methoxypropan-2-yl)-2-methyl-5-propylimidazolidin-4-one

C11H22N2O2 — CID 83240070

IUPAC3-(1-methoxypropan-2-yl)-2-methyl-5-propylimidazolidin-4-one
SMILESCCCC1NC(C)N(C(C)COC)C1=O
InChIInChI=1S/C11H22N2O2/c1-5-6-10-11(14)13(9(3)12-10)8(2)7-15-4/h8-10,12H,5-7H2,1-4H3
InChIKeyIHVTZBUKZVAZSW-UHFFFAOYSA-N
MW214.31 g/mol
LogP0.97
Rot. Bonds5

About 3-(1-methoxypropan-2-yl)-2-methyl-5-propylimidazolidin-4-one

3-(1-methoxypropan-2-yl)-2-methyl-5-propylimidazolidin-4-one (PubChem CID 83240070) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is 3-(1-methoxypropan-2-yl)-2-methyl-5-propylimidazolidin-4-one.

Molecular Properties

Compound Name3-(1-methoxypropan-2-yl)-2-methyl-5-propylimidazolidin-4-one
PubChem CID83240070
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC Name3-(1-methoxypropan-2-yl)-2-methyl-5-propylimidazolidin-4-one
SMILESCCCC1NC(C)N(C(C)COC)C1=O
InChIInChI=1S/C11H22N2O2/c1-5-6-10-11(14)13(9(3)12-10)8(2)7-15-4/h8-10,12H,5-7H2,1-4H3
InChIKeyIHVTZBUKZVAZSW-UHFFFAOYSA-N
XLogP0.97
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 50.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(1-methoxypropan-2-yl)-2,5-dipropylimidazolidin-4-one
CID 83238801
3-(1-methoxypropan-2-yl)-2-methyl-5-(2-phenylethyl)imidazolidin-4-one
CID 114921482
2-methyl-3-(6-methylheptan-2-yl)-5-propylimidazolidin-4-one
CID 83252812
5-butyl-3-(1-methoxypropan-2-yl)-2-propan-2-ylimidazolidin-4-one
CID 83239379
5-butyl-2-methyl-3-pentan-2-ylimidazolidin-4-one
CID 83239016
3-(1-methoxypropan-2-yl)-2-(3-methylphenyl)-5-propylimidazolidin-4-one
CID 83238139
3-(1-methoxypropan-2-yl)-5-propyl-2-thiophen-2-ylimidazolidin-4-one
CID 83239793
3-(2,3-dimethoxypropyl)-2-methyl-5-propylimidazolidin-4-one
CID 114102619
3-(1-ethoxypropan-2-yl)-2-methyl-5-(2-methylpropyl)imidazolidin-4-one
CID 83246403
5-ethyl-3-(1-methoxypentan-2-yl)-2-methylimidazolidin-4-one
CID 83263467
5-butyl-2-methyl-3-(4-methylhexan-2-yl)imidazolidin-4-one
CID 83264581
3-(1-cyclohexylethyl)-2-methyl-5-propylimidazolidin-4-one
CID 83254999

Frequently Asked Questions

What is the IUPAC name of 3-(1-methoxypropan-2-yl)-2-methyl-5-propylimidazolidin-4-one?
The IUPAC name of 3-(1-methoxypropan-2-yl)-2-methyl-5-propylimidazolidin-4-one (CID 83240070) is 3-(1-methoxypropan-2-yl)-2-methyl-5-propylimidazolidin-4-one.
What is the SMILES notation for 3-(1-methoxypropan-2-yl)-2-methyl-5-propylimidazolidin-4-one?
The canonical SMILES for 3-(1-methoxypropan-2-yl)-2-methyl-5-propylimidazolidin-4-one is CCCC1NC(C)N(C(C)COC)C1=O.
What is the InChIKey of 3-(1-methoxypropan-2-yl)-2-methyl-5-propylimidazolidin-4-one?
The InChIKey is IHVTZBUKZVAZSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-5-6-10-11(14)13(9(3)12-10)8(2)7-15-4/h8-10,12H,5-7H2,1-4H3.
What are the key properties of 3-(1-methoxypropan-2-yl)-2-methyl-5-propylimidazolidin-4-one?
3-(1-methoxypropan-2-yl)-2-methyl-5-propylimidazolidin-4-one has a molecular weight of 214.31 g/mol, XLogP of 0.97, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-methoxypropan-2-yl)-2-methyl-5-propylimidazolidin-4-one is sourced from PubChem (CID 83240070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).