5-methyl-2-(2-methylpropyl)-3-(oxolan-2-ylmethyl)imidazolidin-4-one

C13H24N2O2 — CID 83251471

IUPAC5-methyl-2-(2-methylpropyl)-3-(oxolan-2-ylmethyl)imidazolidin-4-one
SMILESCC(C)CC1NC(C)C(=O)N1CC1CCCO1
InChIInChI=1S/C13H24N2O2/c1-9(2)7-12-14-10(3)13(16)15(12)8-11-5-4-6-17-11/h9-12,14H,4-8H2,1-3H3
InChIKeyIDPKRQAFIQINKQ-UHFFFAOYSA-N
MW240.35 g/mol
LogP1.36
Rot. Bonds4

About 5-methyl-2-(2-methylpropyl)-3-(oxolan-2-ylmethyl)imidazolidin-4-one

5-methyl-2-(2-methylpropyl)-3-(oxolan-2-ylmethyl)imidazolidin-4-one (PubChem CID 83251471) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is 5-methyl-2-(2-methylpropyl)-3-(oxolan-2-ylmethyl)imidazolidin-4-one.

Molecular Properties

Compound Name5-methyl-2-(2-methylpropyl)-3-(oxolan-2-ylmethyl)imidazolidin-4-one
PubChem CID83251471
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC Name5-methyl-2-(2-methylpropyl)-3-(oxolan-2-ylmethyl)imidazolidin-4-one
SMILESCC(C)CC1NC(C)C(=O)N1CC1CCCO1
InChIInChI=1S/C13H24N2O2/c1-9(2)7-12-14-10(3)13(16)15(12)8-11-5-4-6-17-11/h9-12,14H,4-8H2,1-3H3
InChIKeyIDPKRQAFIQINKQ-UHFFFAOYSA-N
XLogP1.36
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 ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-methyl-2-(2-methylpropyl)-3-[2-(oxolan-2-yl)ethyl]imidazolidin-4-one
CID 83249314
2,5-dimethyl-3-(oxan-2-ylmethyl)imidazolidin-4-one
CID 83255693
2-ethyl-5-(2-methylpropyl)-3-(oxan-2-ylmethyl)imidazolidin-4-one
CID 83255692
2-cyclopentyl-5-methyl-3-(oxan-2-ylmethyl)imidazolidin-4-one
CID 83256823
2-(2-methylpropyl)-3-[2-(oxolan-2-yl)ethyl]-5-propan-2-ylimidazolidin-4-one
CID 83249091
3-ethyl-5-methyl-2-(2-methylpropyl)imidazolidin-4-one
CID 83239439
5-(2-methylpropyl)-6-(oxan-2-ylmethyl)-4,6-diazaspiro[2.4]heptan-7-one
CID 83256741
3-(2,2-dicyclopropylethyl)-5-methyl-2-(2-methylpropyl)imidazolidin-4-one
CID 83258681
3-(2,3-dimethylbutyl)-5-methyl-2-(2-methylpropyl)imidazolidin-4-one
CID 83258725
3,6-dimethyl-1-(oxan-2-ylmethyl)piperazine-2,5-dione
CID 64874853
2-methyl-3-(oxan-2-ylmethyl)-5-propan-2-ylimidazolidin-4-one
CID 83256490
5-methyl-2-(2-methylpropyl)-3-(oxan-3-yl)imidazolidin-4-one
CID 83263881

Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-(2-methylpropyl)-3-(oxolan-2-ylmethyl)imidazolidin-4-one?
The IUPAC name of 5-methyl-2-(2-methylpropyl)-3-(oxolan-2-ylmethyl)imidazolidin-4-one (CID 83251471) is 5-methyl-2-(2-methylpropyl)-3-(oxolan-2-ylmethyl)imidazolidin-4-one.
What is the SMILES notation for 5-methyl-2-(2-methylpropyl)-3-(oxolan-2-ylmethyl)imidazolidin-4-one?
The canonical SMILES for 5-methyl-2-(2-methylpropyl)-3-(oxolan-2-ylmethyl)imidazolidin-4-one is CC(C)CC1NC(C)C(=O)N1CC1CCCO1.
What is the InChIKey of 5-methyl-2-(2-methylpropyl)-3-(oxolan-2-ylmethyl)imidazolidin-4-one?
The InChIKey is IDPKRQAFIQINKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2/c1-9(2)7-12-14-10(3)13(16)15(12)8-11-5-4-6-17-11/h9-12,14H,4-8H2,1-3H3.
What are the key properties of 5-methyl-2-(2-methylpropyl)-3-(oxolan-2-ylmethyl)imidazolidin-4-one?
5-methyl-2-(2-methylpropyl)-3-(oxolan-2-ylmethyl)imidazolidin-4-one has a molecular weight of 240.35 g/mol, XLogP of 1.36, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-(2-methylpropyl)-3-(oxolan-2-ylmethyl)imidazolidin-4-one is sourced from PubChem (CID 83251471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).