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

C12H24N2O — CID 83260681

IUPAC5-butan-2-yl-3-methyl-2-(2-methylpropyl)imidazolidin-4-one
SMILESCCC(C)C1NC(CC(C)C)N(C)C1=O
InChIInChI=1S/C12H24N2O/c1-6-9(4)11-12(15)14(5)10(13-11)7-8(2)3/h8-11,13H,6-7H2,1-5H3
InChIKeyUJQRAWINMUKOQU-UHFFFAOYSA-N
MW212.34 g/mol
LogP1.83
Rot. Bonds4

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

5-butan-2-yl-3-methyl-2-(2-methylpropyl)imidazolidin-4-one (PubChem CID 83260681) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is 5-butan-2-yl-3-methyl-2-(2-methylpropyl)imidazolidin-4-one.

Molecular Properties

Compound Name5-butan-2-yl-3-methyl-2-(2-methylpropyl)imidazolidin-4-one
PubChem CID83260681
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC Name5-butan-2-yl-3-methyl-2-(2-methylpropyl)imidazolidin-4-one
SMILESCCC(C)C1NC(CC(C)C)N(C)C1=O
InChIInChI=1S/C12H24N2O/c1-6-9(4)11-12(15)14(5)10(13-11)7-8(2)3/h8-11,13H,6-7H2,1-5H3
InChIKeyUJQRAWINMUKOQU-UHFFFAOYSA-N
XLogP1.83
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-butan-2-yl-3-methyl-2-propylimidazolidin-4-one
CID 83260057
5-butan-2-yl-3-(3-methylbutyl)-2-(2-methylpropyl)imidazolidin-4-one
CID 83237061
5-butan-2-yl-2-(2-methylpropyl)-3-pentylimidazolidin-4-one
CID 83250722
5-butan-2-yl-3-cyclobutyl-2-(2-methylpropyl)imidazolidin-4-one
CID 83254319
5-butan-2-yl-3-(1-ethoxypropan-2-yl)-2-(2-methylpropyl)imidazolidin-4-one
CID 83245364
5-butan-2-yl-3-(3-methylcyclopentyl)-2-(2-methylpropyl)imidazolidin-4-one
CID 114552346
5-butan-2-yl-2-(2-methylpropyl)-3-(thian-2-ylmethyl)imidazolidin-4-one
CID 83266972
5-butan-2-yl-3-pentan-3-yl-2-propylimidazolidin-4-one
CID 83241971
5-butan-2-yl-3-(5-methylhexan-2-yl)-2-propylimidazolidin-4-one
CID 83263112
5-butan-2-yl-3-methyl-2-(5-methylthiophen-2-yl)imidazolidin-4-one
CID 83260139
5-butan-2-yl-3-[2-(dimethylamino)ethyl]-2-propylimidazolidin-4-one
CID 83250833
(3S,6R,9S,12S,15R,18S)-3,6,12-tris[(2S)-butan-2-yl]-9,15,18-tris(2-methylpropyl)-1,4,7,10,13,16-hexazacyclooctadecane-2,5,8,11,14,17-hexone
CID 146035611

Frequently Asked Questions

What is the IUPAC name of 5-butan-2-yl-3-methyl-2-(2-methylpropyl)imidazolidin-4-one?
The IUPAC name of 5-butan-2-yl-3-methyl-2-(2-methylpropyl)imidazolidin-4-one (CID 83260681) is 5-butan-2-yl-3-methyl-2-(2-methylpropyl)imidazolidin-4-one.
What is the SMILES notation for 5-butan-2-yl-3-methyl-2-(2-methylpropyl)imidazolidin-4-one?
The canonical SMILES for 5-butan-2-yl-3-methyl-2-(2-methylpropyl)imidazolidin-4-one is CCC(C)C1NC(CC(C)C)N(C)C1=O.
What is the InChIKey of 5-butan-2-yl-3-methyl-2-(2-methylpropyl)imidazolidin-4-one?
The InChIKey is UJQRAWINMUKOQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O/c1-6-9(4)11-12(15)14(5)10(13-11)7-8(2)3/h8-11,13H,6-7H2,1-5H3.
What are the key properties of 5-butan-2-yl-3-methyl-2-(2-methylpropyl)imidazolidin-4-one?
5-butan-2-yl-3-methyl-2-(2-methylpropyl)imidazolidin-4-one has a molecular weight of 212.34 g/mol, XLogP of 1.83, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-butan-2-yl-3-methyl-2-(2-methylpropyl)imidazolidin-4-one is sourced from PubChem (CID 83260681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).