3-(1-methoxypropan-2-yl)-2,5-dipropylimidazolidin-4-one

C13H26N2O2 — CID 83238801

IUPAC3-(1-methoxypropan-2-yl)-2,5-dipropylimidazolidin-4-one
SMILESCCCC1NC(CCC)N(C(C)COC)C1=O
InChIInChI=1S/C13H26N2O2/c1-5-7-11-13(16)15(10(3)9-17-4)12(14-11)8-6-2/h10-12,14H,5-9H2,1-4H3
InChIKeyQMBVNWPMWGXFDG-UHFFFAOYSA-N
MW242.36 g/mol
LogP1.75
Rot. Bonds7

About 3-(1-methoxypropan-2-yl)-2,5-dipropylimidazolidin-4-one

3-(1-methoxypropan-2-yl)-2,5-dipropylimidazolidin-4-one (PubChem CID 83238801) has the molecular formula C13H26N2O2 and a molecular weight of 242.36 g/mol. Its IUPAC name is 3-(1-methoxypropan-2-yl)-2,5-dipropylimidazolidin-4-one.

Molecular Properties

Compound Name3-(1-methoxypropan-2-yl)-2,5-dipropylimidazolidin-4-one
PubChem CID83238801
Molecular FormulaC13H26N2O2
Molecular Weight242.36 g/mol
Exact Mass242.20
IUPAC Name3-(1-methoxypropan-2-yl)-2,5-dipropylimidazolidin-4-one
SMILESCCCC1NC(CCC)N(C(C)COC)C1=O
InChIInChI=1S/C13H26N2O2/c1-5-7-11-13(16)15(10(3)9-17-4)12(14-11)8-6-2/h10-12,14H,5-9H2,1-4H3
InChIKeyQMBVNWPMWGXFDG-UHFFFAOYSA-N
XLogP1.75
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.36
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(1-methoxypropan-2-yl)-2-methyl-5-propylimidazolidin-4-one
CID 83240070
3-pentan-2-yl-2,5-dipropylimidazolidin-4-one
CID 83238815
5-butyl-3-(1-methoxypropan-2-yl)-2-propan-2-ylimidazolidin-4-one
CID 83239379
3-(1-methoxypentan-2-yl)-2-(2-methylpropyl)-5-propylimidazolidin-4-one
CID 83262701
3-(1-cyclopropylethyl)-2,5-dipropylimidazolidin-4-one
CID 83243771
3-(1-methoxypropan-2-yl)-5-propyl-2-thiophen-2-ylimidazolidin-4-one
CID 83239793
3-(1-methoxypropan-2-yl)-2-(3-methylphenyl)-5-propylimidazolidin-4-one
CID 83238139
5-butyl-3-(1-methoxypropan-2-yl)-2-phenylimidazolidin-4-one
CID 83237900
3-(4-methylhexan-2-yl)-2-(2-methylpropyl)-5-propylimidazolidin-4-one
CID 83264410
5-butyl-3-(3,3-dimethylbutan-2-yl)-2-propylimidazolidin-4-one
CID 104830708
5-butyl-3-(2-methylpentan-3-yl)-2-propylimidazolidin-4-one
CID 83245310
5-butan-2-yl-3-(1-ethoxypropan-2-yl)-2-propylimidazolidin-4-one
CID 83247716

Frequently Asked Questions

What is the IUPAC name of 3-(1-methoxypropan-2-yl)-2,5-dipropylimidazolidin-4-one?
The IUPAC name of 3-(1-methoxypropan-2-yl)-2,5-dipropylimidazolidin-4-one (CID 83238801) is 3-(1-methoxypropan-2-yl)-2,5-dipropylimidazolidin-4-one.
What is the SMILES notation for 3-(1-methoxypropan-2-yl)-2,5-dipropylimidazolidin-4-one?
The canonical SMILES for 3-(1-methoxypropan-2-yl)-2,5-dipropylimidazolidin-4-one is CCCC1NC(CCC)N(C(C)COC)C1=O.
What is the InChIKey of 3-(1-methoxypropan-2-yl)-2,5-dipropylimidazolidin-4-one?
The InChIKey is QMBVNWPMWGXFDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O2/c1-5-7-11-13(16)15(10(3)9-17-4)12(14-11)8-6-2/h10-12,14H,5-9H2,1-4H3.
What are the key properties of 3-(1-methoxypropan-2-yl)-2,5-dipropylimidazolidin-4-one?
3-(1-methoxypropan-2-yl)-2,5-dipropylimidazolidin-4-one has a molecular weight of 242.36 g/mol, XLogP of 1.75, 7 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)-2,5-dipropylimidazolidin-4-one is sourced from PubChem (CID 83238801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).