5-butan-2-yl-2-methyl-3-(oxan-3-yl)imidazolidin-4-one

C13H24N2O2 — CID 83264762

IUPAC5-butan-2-yl-2-methyl-3-(oxan-3-yl)imidazolidin-4-one
SMILESCCC(C)C1NC(C)N(C2CCCOC2)C1=O
InChIInChI=1S/C13H24N2O2/c1-4-9(2)12-13(16)15(10(3)14-12)11-6-5-7-17-8-11/h9-12,14H,4-8H2,1-3H3
InChIKeyRZQYGKJRIWNIDY-UHFFFAOYSA-N
MW240.35 g/mol
LogP1.36
Rot. Bonds3

About 5-butan-2-yl-2-methyl-3-(oxan-3-yl)imidazolidin-4-one

5-butan-2-yl-2-methyl-3-(oxan-3-yl)imidazolidin-4-one (PubChem CID 83264762) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is 5-butan-2-yl-2-methyl-3-(oxan-3-yl)imidazolidin-4-one.

Molecular Properties

Compound Name5-butan-2-yl-2-methyl-3-(oxan-3-yl)imidazolidin-4-one
PubChem CID83264762
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC Name5-butan-2-yl-2-methyl-3-(oxan-3-yl)imidazolidin-4-one
SMILESCCC(C)C1NC(C)N(C2CCCOC2)C1=O
InChIInChI=1S/C13H24N2O2/c1-4-9(2)12-13(16)15(10(3)14-12)11-6-5-7-17-8-11/h9-12,14H,4-8H2,1-3H3
InChIKeyRZQYGKJRIWNIDY-UHFFFAOYSA-N
XLogP1.36
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
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

Analyze 5-butan-2-yl-2-methyl-3-(oxan-3-yl)imidazolidin-4-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-butan-2-yl-2-methyl-3-(oxan-3-ylmethyl)imidazolidin-4-one
CID 83250080
5-butan-2-yl-3-(3,4-dimethylcyclohexyl)-2-methylimidazolidin-4-one
CID 83263151
3-(oxan-3-yl)-5-propan-2-yl-2-propylimidazolidin-4-one
CID 83263063
3-butan-2-yl-7-methyl-1-(oxolan-3-yl)-1,4-diazepane-2,5-dione
CID 64882943
3-butan-2-yl-6-ethyl-1-(oxolan-3-yl)piperazine-2,5-dione
CID 64902522
5-methyl-2-(2-methylpropyl)-3-(oxan-3-yl)imidazolidin-4-one
CID 83263881
3-butan-2-yl-6-tert-butyl-1-(oxolan-3-yl)piperazine-2,5-dione
CID 64903462
3-cyclobutyl-2-methyl-5-propan-2-ylimidazolidin-4-one
CID 83254569
5-butan-2-yl-3-(dicyclopropylmethyl)-2-methylimidazolidin-4-one
CID 83253008
5-butan-2-yl-3-cyclobutyl-2-(2-methylpropyl)imidazolidin-4-one
CID 83254319
5-butyl-3-(oxan-3-yl)-2-propan-2-ylimidazolidin-4-one
CID 83262754
5-butan-2-yl-2-ethyl-3-(2-methyloxolan-3-yl)imidazolidin-4-one
CID 83259587

Frequently Asked Questions

What is the IUPAC name of 5-butan-2-yl-2-methyl-3-(oxan-3-yl)imidazolidin-4-one?
The IUPAC name of 5-butan-2-yl-2-methyl-3-(oxan-3-yl)imidazolidin-4-one (CID 83264762) is 5-butan-2-yl-2-methyl-3-(oxan-3-yl)imidazolidin-4-one.
What is the SMILES notation for 5-butan-2-yl-2-methyl-3-(oxan-3-yl)imidazolidin-4-one?
The canonical SMILES for 5-butan-2-yl-2-methyl-3-(oxan-3-yl)imidazolidin-4-one is CCC(C)C1NC(C)N(C2CCCOC2)C1=O.
What is the InChIKey of 5-butan-2-yl-2-methyl-3-(oxan-3-yl)imidazolidin-4-one?
The InChIKey is RZQYGKJRIWNIDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2/c1-4-9(2)12-13(16)15(10(3)14-12)11-6-5-7-17-8-11/h9-12,14H,4-8H2,1-3H3.
What are the key properties of 5-butan-2-yl-2-methyl-3-(oxan-3-yl)imidazolidin-4-one?
5-butan-2-yl-2-methyl-3-(oxan-3-yl)imidazolidin-4-one has a molecular weight of 240.35 g/mol, XLogP of 1.36, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-butan-2-yl-2-methyl-3-(oxan-3-yl)imidazolidin-4-one is sourced from PubChem (CID 83264762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).