3-(2-methylbutyl)-5-propylimidazolidin-4-one

C11H22N2O — CID 83253599

IUPAC3-(2-methylbutyl)-5-propylimidazolidin-4-one
SMILESCCCC1NCN(CC(C)CC)C1=O
InChIInChI=1S/C11H22N2O/c1-4-6-10-11(14)13(8-12-10)7-9(3)5-2/h9-10,12H,4-8H2,1-3H3
InChIKeyHWNVBHSWHZCKCF-UHFFFAOYSA-N
MW198.31 g/mol
LogP1.59
Rot. Bonds5

About 3-(2-methylbutyl)-5-propylimidazolidin-4-one

3-(2-methylbutyl)-5-propylimidazolidin-4-one (PubChem CID 83253599) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is 3-(2-methylbutyl)-5-propylimidazolidin-4-one.

Molecular Properties

Compound Name3-(2-methylbutyl)-5-propylimidazolidin-4-one
PubChem CID83253599
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC Name3-(2-methylbutyl)-5-propylimidazolidin-4-one
SMILESCCCC1NCN(CC(C)CC)C1=O
InChIInChI=1S/C11H22N2O/c1-4-6-10-11(14)13(8-12-10)7-9(3)5-2/h9-10,12H,4-8H2,1-3H3
InChIKeyHWNVBHSWHZCKCF-UHFFFAOYSA-N
XLogP1.59
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[2-(dimethylamino)ethyl]-5-propylimidazolidin-4-one
CID 83251427
5-ethyl-3-(3-methoxy-2-methylpropyl)imidazolidin-4-one
CID 83249714
5-ethyl-3-(3-methyl-2-propan-2-ylbutyl)imidazolidin-4-one
CID 102916025
3-[4-[methyl(propan-2-yl)amino]butyl]-5-propylimidazolidin-4-one
CID 83248232
3-(2-methyl-3-methylsulfanylpropyl)-5-(2-methylpropyl)imidazolidin-4-one
CID 83257472
5-butyl-3-(4-methylpentyl)imidazolidin-4-one
CID 83257839
3-(3-ethoxypropyl)-5-propylimidazolidin-4-one
CID 83237865
5-propyl-3-(2-thiomorpholin-4-ylethyl)imidazolidin-4-one
CID 106327103
3-[(2-methylcyclohexyl)methyl]-5-propylimidazolidin-4-one
CID 83256567
3-heptan-2-yl-5-propylimidazolidin-4-one
CID 83253979
3-(1-cyclopropylpropan-2-yl)-5-propylimidazolidin-4-one
CID 83257228
5-butyl-3-decylimidazolidin-4-one
CID 83270318

Frequently Asked Questions

What is the IUPAC name of 3-(2-methylbutyl)-5-propylimidazolidin-4-one?
The IUPAC name of 3-(2-methylbutyl)-5-propylimidazolidin-4-one (CID 83253599) is 3-(2-methylbutyl)-5-propylimidazolidin-4-one.
What is the SMILES notation for 3-(2-methylbutyl)-5-propylimidazolidin-4-one?
The canonical SMILES for 3-(2-methylbutyl)-5-propylimidazolidin-4-one is CCCC1NCN(CC(C)CC)C1=O.
What is the InChIKey of 3-(2-methylbutyl)-5-propylimidazolidin-4-one?
The InChIKey is HWNVBHSWHZCKCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O/c1-4-6-10-11(14)13(8-12-10)7-9(3)5-2/h9-10,12H,4-8H2,1-3H3.
What are the key properties of 3-(2-methylbutyl)-5-propylimidazolidin-4-one?
3-(2-methylbutyl)-5-propylimidazolidin-4-one has a molecular weight of 198.31 g/mol, XLogP of 1.59, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methylbutyl)-5-propylimidazolidin-4-one is sourced from PubChem (CID 83253599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).