5-ethyl-3-(3-methoxypropyl)-5-methylimidazolidin-4-one

C10H20N2O2 — CID 83244125

IUPAC5-ethyl-3-(3-methoxypropyl)-5-methylimidazolidin-4-one
SMILESCCC1(C)NCN(CCCOC)C1=O
InChIInChI=1S/C10H20N2O2/c1-4-10(2)9(13)12(8-11-10)6-5-7-14-3/h11H,4-8H2,1-3H3
InChIKeyHFHBNWIUSQQIMH-UHFFFAOYSA-N
MW200.28 g/mol
LogP0.58
Rot. Bonds5

About 5-ethyl-3-(3-methoxypropyl)-5-methylimidazolidin-4-one

5-ethyl-3-(3-methoxypropyl)-5-methylimidazolidin-4-one (PubChem CID 83244125) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is 5-ethyl-3-(3-methoxypropyl)-5-methylimidazolidin-4-one.

Molecular Properties

Compound Name5-ethyl-3-(3-methoxypropyl)-5-methylimidazolidin-4-one
PubChem CID83244125
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC Name5-ethyl-3-(3-methoxypropyl)-5-methylimidazolidin-4-one
SMILESCCC1(C)NCN(CCCOC)C1=O
InChIInChI=1S/C10H20N2O2/c1-4-10(2)9(13)12(8-11-10)6-5-7-14-3/h11H,4-8H2,1-3H3
InChIKeyHFHBNWIUSQQIMH-UHFFFAOYSA-N
XLogP0.58
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 50.58
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

5-ethyl-5-methyl-3-propylimidazolidin-4-one
CID 83242935
5-ethyl-5-methyl-3-(4-methylpentyl)imidazolidin-4-one
CID 83255365
5-ethyl-3-(2-fluoroethyl)-5-methylimidazolidin-4-one
CID 130504764
5-ethyl-5-methyl-3-[2-(2,2,2-trifluoroethoxy)ethyl]imidazolidin-4-one
CID 83263391
5-ethyl-5-methyl-3-[(2,2,3,3-tetramethylcyclopropyl)methyl]imidazolidin-4-one
CID 83259439
1-(3-methoxypropyl)-3,3-dimethylpiperazin-2-one
CID 63602475
3-(2-cyclopentylethyl)-5-ethyl-5-methylimidazolidin-4-one
CID 83256191
3-(2-cyclohexylethyl)-5-ethyl-5-methylimidazolidin-4-one
CID 83256196
5-ethyl-5-methyl-3-[(1-methylpiperidin-4-yl)methyl]imidazolidin-4-one
CID 83249853
1-(3-methoxypropyl)-3,3-dimethyl-1,4-diazocan-2-one
CID 117016400
5-ethyl-3-(1-methoxy-3-methylbutan-2-yl)-5-methylimidazolidin-4-one
CID 83258249
1-(3-ethoxypropyl)-3-ethyl-3-methylpiperazine-2,5-dione
CID 64958561

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-3-(3-methoxypropyl)-5-methylimidazolidin-4-one?
The IUPAC name of 5-ethyl-3-(3-methoxypropyl)-5-methylimidazolidin-4-one (CID 83244125) is 5-ethyl-3-(3-methoxypropyl)-5-methylimidazolidin-4-one.
What is the SMILES notation for 5-ethyl-3-(3-methoxypropyl)-5-methylimidazolidin-4-one?
The canonical SMILES for 5-ethyl-3-(3-methoxypropyl)-5-methylimidazolidin-4-one is CCC1(C)NCN(CCCOC)C1=O.
What is the InChIKey of 5-ethyl-3-(3-methoxypropyl)-5-methylimidazolidin-4-one?
The InChIKey is HFHBNWIUSQQIMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-4-10(2)9(13)12(8-11-10)6-5-7-14-3/h11H,4-8H2,1-3H3.
What are the key properties of 5-ethyl-3-(3-methoxypropyl)-5-methylimidazolidin-4-one?
5-ethyl-3-(3-methoxypropyl)-5-methylimidazolidin-4-one has a molecular weight of 200.28 g/mol, XLogP of 0.58, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-3-(3-methoxypropyl)-5-methylimidazolidin-4-one is sourced from PubChem (CID 83244125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).