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

C16H32N2O — CID 83237061

IUPAC5-butan-2-yl-3-(3-methylbutyl)-2-(2-methylpropyl)imidazolidin-4-one
SMILESCCC(C)C1NC(CC(C)C)N(CCC(C)C)C1=O
InChIInChI=1S/C16H32N2O/c1-7-13(6)15-16(19)18(9-8-11(2)3)14(17-15)10-12(4)5/h11-15,17H,7-10H2,1-6H3
InChIKeyPODGNFWMDWVAIS-UHFFFAOYSA-N
MW268.44 g/mol
LogP3.25
Rot. Bonds7

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

5-butan-2-yl-3-(3-methylbutyl)-2-(2-methylpropyl)imidazolidin-4-one (PubChem CID 83237061) has the molecular formula C16H32N2O and a molecular weight of 268.44 g/mol. Its IUPAC name is 5-butan-2-yl-3-(3-methylbutyl)-2-(2-methylpropyl)imidazolidin-4-one.

Molecular Properties

Compound Name5-butan-2-yl-3-(3-methylbutyl)-2-(2-methylpropyl)imidazolidin-4-one
PubChem CID83237061
Molecular FormulaC16H32N2O
Molecular Weight268.44 g/mol
Exact Mass268.25
IUPAC Name5-butan-2-yl-3-(3-methylbutyl)-2-(2-methylpropyl)imidazolidin-4-one
SMILESCCC(C)C1NC(CC(C)C)N(CCC(C)C)C1=O
InChIInChI=1S/C16H32N2O/c1-7-13(6)15-16(19)18(9-8-11(2)3)14(17-15)10-12(4)5/h11-15,17H,7-10H2,1-6H3
InChIKeyPODGNFWMDWVAIS-UHFFFAOYSA-N
XLogP3.25
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.44
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-butan-2-yl-2-(2-methylpropyl)-3-pentylimidazolidin-4-one
CID 83250722
5-butan-2-yl-3-methyl-2-(2-methylpropyl)imidazolidin-4-one
CID 83260681
3-(4-methylpentyl)-2-(2-methylpropyl)-5-propan-2-ylimidazolidin-4-one
CID 83254785
3-butan-2-yl-1-(3-methylbutyl)-6-(2-methylpropyl)piperazine-2,5-dione
CID 64902911
5-butan-2-yl-2-(2-methylpropyl)-3-(thian-2-ylmethyl)imidazolidin-4-one
CID 83266972
5-butan-2-yl-3-cyclobutyl-2-(2-methylpropyl)imidazolidin-4-one
CID 83254319
5-butan-2-yl-3-[2-(dimethylamino)ethyl]-2-propylimidazolidin-4-one
CID 83250833
3-(4-methylpentyl)-2,5-bis(2-methylpropyl)imidazolidin-4-one
CID 83254863
5-butan-2-yl-2-ethyl-3-(4,4,4-trifluorobutyl)imidazolidin-4-one
CID 83260297
5-butan-2-yl-3-(1-ethoxypropan-2-yl)-2-(2-methylpropyl)imidazolidin-4-one
CID 83245364
5-butan-2-yl-3-methyl-2-propylimidazolidin-4-one
CID 83260057
5-butan-2-yl-2-ethyl-3-[2-(2-methoxyethoxy)ethyl]imidazolidin-4-one
CID 83245523

Frequently Asked Questions

What is the IUPAC name of 5-butan-2-yl-3-(3-methylbutyl)-2-(2-methylpropyl)imidazolidin-4-one?
The IUPAC name of 5-butan-2-yl-3-(3-methylbutyl)-2-(2-methylpropyl)imidazolidin-4-one (CID 83237061) is 5-butan-2-yl-3-(3-methylbutyl)-2-(2-methylpropyl)imidazolidin-4-one.
What is the SMILES notation for 5-butan-2-yl-3-(3-methylbutyl)-2-(2-methylpropyl)imidazolidin-4-one?
The canonical SMILES for 5-butan-2-yl-3-(3-methylbutyl)-2-(2-methylpropyl)imidazolidin-4-one is CCC(C)C1NC(CC(C)C)N(CCC(C)C)C1=O.
What is the InChIKey of 5-butan-2-yl-3-(3-methylbutyl)-2-(2-methylpropyl)imidazolidin-4-one?
The InChIKey is PODGNFWMDWVAIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2O/c1-7-13(6)15-16(19)18(9-8-11(2)3)14(17-15)10-12(4)5/h11-15,17H,7-10H2,1-6H3.
What are the key properties of 5-butan-2-yl-3-(3-methylbutyl)-2-(2-methylpropyl)imidazolidin-4-one?
5-butan-2-yl-3-(3-methylbutyl)-2-(2-methylpropyl)imidazolidin-4-one has a molecular weight of 268.44 g/mol, XLogP of 3.25, 7 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-(3-methylbutyl)-2-(2-methylpropyl)imidazolidin-4-one is sourced from PubChem (CID 83237061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).