5-(2-methylpropyl)-3-pentan-3-ylimidazolidin-4-one

C12H24N2O — CID 83242760

IUPAC5-(2-methylpropyl)-3-pentan-3-ylimidazolidin-4-one
SMILESCCC(CC)N1CNC(CC(C)C)C1=O
InChIInChI=1S/C12H24N2O/c1-5-10(6-2)14-8-13-11(12(14)15)7-9(3)4/h9-11,13H,5-8H2,1-4H3
InChIKeyGUBUWKLBPLHNAB-UHFFFAOYSA-N
MW212.34 g/mol
LogP1.98
Rot. Bonds5

About 5-(2-methylpropyl)-3-pentan-3-ylimidazolidin-4-one

5-(2-methylpropyl)-3-pentan-3-ylimidazolidin-4-one (PubChem CID 83242760) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is 5-(2-methylpropyl)-3-pentan-3-ylimidazolidin-4-one.

Molecular Properties

Compound Name5-(2-methylpropyl)-3-pentan-3-ylimidazolidin-4-one
PubChem CID83242760
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC Name5-(2-methylpropyl)-3-pentan-3-ylimidazolidin-4-one
SMILESCCC(CC)N1CNC(CC(C)C)C1=O
InChIInChI=1S/C12H24N2O/c1-5-10(6-2)14-8-13-11(12(14)15)7-9(3)4/h9-11,13H,5-8H2,1-4H3
InChIKeyGUBUWKLBPLHNAB-UHFFFAOYSA-N
XLogP1.98
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(1-methoxybutan-2-yl)-5-(2-methylpropyl)imidazolidin-4-one
CID 83258633
3-(3,3-dimethylbutan-2-yl)-5-(2-methylpropyl)imidazolidin-4-one
CID 104830706
3-(1-cyclopropylpropan-2-yl)-5-(2-methylpropyl)imidazolidin-4-one
CID 83257317
3-heptan-2-yl-5-(2-methylpropyl)imidazolidin-4-one
CID 83254098
5-(2-methylpropyl)-3-octan-2-ylimidazolidin-4-one
CID 83246616
3-(3-methylbutyl)-5-(2-methylpropyl)imidazolidin-4-one
CID 83238290
5-(2-methylpropyl)-3-(2-methylsulfanylethyl)imidazolidin-4-one
CID 83257953
5-(2-methylpropyl)-3-(3,3,5,5-tetramethylcyclohexyl)imidazolidin-4-one
CID 103968852
5-(2-methylpropyl)-3-[(2,2,3,3-tetramethylcyclopropyl)methyl]imidazolidin-4-one
CID 83258955
3-(2-methyl-3-methylsulfanylpropyl)-5-(2-methylpropyl)imidazolidin-4-one
CID 83257472
5-butyl-3-octan-4-ylimidazolidin-4-one
CID 106021472
3-(1-cyclopropylpropan-2-yl)-5-propylimidazolidin-4-one
CID 83257228

Frequently Asked Questions

What is the IUPAC name of 5-(2-methylpropyl)-3-pentan-3-ylimidazolidin-4-one?
The IUPAC name of 5-(2-methylpropyl)-3-pentan-3-ylimidazolidin-4-one (CID 83242760) is 5-(2-methylpropyl)-3-pentan-3-ylimidazolidin-4-one.
What is the SMILES notation for 5-(2-methylpropyl)-3-pentan-3-ylimidazolidin-4-one?
The canonical SMILES for 5-(2-methylpropyl)-3-pentan-3-ylimidazolidin-4-one is CCC(CC)N1CNC(CC(C)C)C1=O.
What is the InChIKey of 5-(2-methylpropyl)-3-pentan-3-ylimidazolidin-4-one?
The InChIKey is GUBUWKLBPLHNAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O/c1-5-10(6-2)14-8-13-11(12(14)15)7-9(3)4/h9-11,13H,5-8H2,1-4H3.
What are the key properties of 5-(2-methylpropyl)-3-pentan-3-ylimidazolidin-4-one?
5-(2-methylpropyl)-3-pentan-3-ylimidazolidin-4-one has a molecular weight of 212.34 g/mol, XLogP of 1.98, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-methylpropyl)-3-pentan-3-ylimidazolidin-4-one is sourced from PubChem (CID 83242760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).