3-(2-butoxyethyl)-5-(2-methylpropyl)-2-propylimidazolidin-4-one

C16H32N2O2 — CID 83253671

IUPAC3-(2-butoxyethyl)-5-(2-methylpropyl)-2-propylimidazolidin-4-one
SMILESCCCCOCCN1C(=O)C(CC(C)C)NC1CCC
InChIInChI=1S/C16H32N2O2/c1-5-7-10-20-11-9-18-15(8-6-2)17-14(16(18)19)12-13(3)4/h13-15,17H,5-12H2,1-4H3
InChIKeyNOXKQIMGQNZWMI-UHFFFAOYSA-N
MW284.44 g/mol
LogP2.78
Rot. Bonds10

About 3-(2-butoxyethyl)-5-(2-methylpropyl)-2-propylimidazolidin-4-one

3-(2-butoxyethyl)-5-(2-methylpropyl)-2-propylimidazolidin-4-one (PubChem CID 83253671) has the molecular formula C16H32N2O2 and a molecular weight of 284.44 g/mol. Its IUPAC name is 3-(2-butoxyethyl)-5-(2-methylpropyl)-2-propylimidazolidin-4-one.

Molecular Properties

Compound Name3-(2-butoxyethyl)-5-(2-methylpropyl)-2-propylimidazolidin-4-one
PubChem CID83253671
Molecular FormulaC16H32N2O2
Molecular Weight284.44 g/mol
Exact Mass284.25
IUPAC Name3-(2-butoxyethyl)-5-(2-methylpropyl)-2-propylimidazolidin-4-one
SMILESCCCCOCCN1C(=O)C(CC(C)C)NC1CCC
InChIInChI=1S/C16H32N2O2/c1-5-7-10-20-11-9-18-15(8-6-2)17-14(16(18)19)12-13(3)4/h13-15,17H,5-12H2,1-4H3
InChIKeyNOXKQIMGQNZWMI-UHFFFAOYSA-N
XLogP2.78
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.44
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

3-(2-cyclopentyloxyethyl)-5-(2-methylpropyl)-2-propylimidazolidin-4-one
CID 83264483
2-ethyl-5-(2-methylpropyl)-3-(3-propoxypropyl)imidazolidin-4-one
CID 83260824
5-(2-methylpropyl)-3-(2-methylsulfonylethyl)-2-propylimidazolidin-4-one
CID 83256860
5-ethyl-2-(2-methylpropyl)-3-(3-propoxypropyl)imidazolidin-4-one
CID 83260919
2-ethyl-5-(2-methylpropyl)-3-octylimidazolidin-4-one
CID 83260834
5-ethyl-3-[2-(3-methylbutoxy)ethyl]-2-(2-methylpropyl)imidazolidin-4-one
CID 83253960
5-butyl-3-(2-cyclopentyloxyethyl)-2-propylimidazolidin-4-one
CID 83264500
5-(2-methylpropyl)-3-[2-(oxolan-2-yl)ethyl]-2-propylimidazolidin-4-one
CID 83248880
3-(3-methoxypropyl)-2-(2-methylpropyl)-5-propylimidazolidin-4-one
CID 83243478
3-(cyclohexylmethyl)-5-(2-methylpropyl)-2-propylimidazolidin-4-one
CID 83244505
3-(2-butoxyethyl)-2-ethyl-5-propan-2-ylimidazolidin-4-one
CID 83253847
2-(2-methylpropyl)-3,5-dipropylimidazolidin-4-one
CID 83242530

Frequently Asked Questions

What is the IUPAC name of 3-(2-butoxyethyl)-5-(2-methylpropyl)-2-propylimidazolidin-4-one?
The IUPAC name of 3-(2-butoxyethyl)-5-(2-methylpropyl)-2-propylimidazolidin-4-one (CID 83253671) is 3-(2-butoxyethyl)-5-(2-methylpropyl)-2-propylimidazolidin-4-one.
What is the SMILES notation for 3-(2-butoxyethyl)-5-(2-methylpropyl)-2-propylimidazolidin-4-one?
The canonical SMILES for 3-(2-butoxyethyl)-5-(2-methylpropyl)-2-propylimidazolidin-4-one is CCCCOCCN1C(=O)C(CC(C)C)NC1CCC.
What is the InChIKey of 3-(2-butoxyethyl)-5-(2-methylpropyl)-2-propylimidazolidin-4-one?
The InChIKey is NOXKQIMGQNZWMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2O2/c1-5-7-10-20-11-9-18-15(8-6-2)17-14(16(18)19)12-13(3)4/h13-15,17H,5-12H2,1-4H3.
What are the key properties of 3-(2-butoxyethyl)-5-(2-methylpropyl)-2-propylimidazolidin-4-one?
3-(2-butoxyethyl)-5-(2-methylpropyl)-2-propylimidazolidin-4-one has a molecular weight of 284.44 g/mol, XLogP of 2.78, 10 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-butoxyethyl)-5-(2-methylpropyl)-2-propylimidazolidin-4-one is sourced from PubChem (CID 83253671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).