2-ethyl-3-(2-methyl-3-methylsulfanylpropyl)imidazolidin-4-one

C10H20N2OS — CID 83258052

IUPAC2-ethyl-3-(2-methyl-3-methylsulfanylpropyl)imidazolidin-4-one
SMILESCCC1NCC(=O)N1CC(C)CSC
InChIInChI=1S/C10H20N2OS/c1-4-9-11-5-10(13)12(9)6-8(2)7-14-3/h8-9,11H,4-7H2,1-3H3
InChIKeyXAQLVVGYFFCTRE-UHFFFAOYSA-N
MW216.35 g/mol
LogP1.15
Rot. Bonds5

About 2-ethyl-3-(2-methyl-3-methylsulfanylpropyl)imidazolidin-4-one

2-ethyl-3-(2-methyl-3-methylsulfanylpropyl)imidazolidin-4-one (PubChem CID 83258052) has the molecular formula C10H20N2OS and a molecular weight of 216.35 g/mol. Its IUPAC name is 2-ethyl-3-(2-methyl-3-methylsulfanylpropyl)imidazolidin-4-one.

Molecular Properties

Compound Name2-ethyl-3-(2-methyl-3-methylsulfanylpropyl)imidazolidin-4-one
PubChem CID83258052
Molecular FormulaC10H20N2OS
Molecular Weight216.35 g/mol
Exact Mass216.13
IUPAC Name2-ethyl-3-(2-methyl-3-methylsulfanylpropyl)imidazolidin-4-one
SMILESCCC1NCC(=O)N1CC(C)CSC
InChIInChI=1S/C10H20N2OS/c1-4-9-11-5-10(13)12(9)6-8(2)7-14-3/h8-9,11H,4-7H2,1-3H3
InChIKeyXAQLVVGYFFCTRE-UHFFFAOYSA-N
XLogP1.15
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.35
LogP ≤ 51.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[2-(dimethylamino)propyl]-2-ethylimidazolidin-4-one
CID 83250205
2-ethyl-3-(2-piperidin-1-ylpropyl)imidazolidin-4-one
CID 83249426
2-(4-chlorophenyl)-3-(2-methyl-3-methylsulfanylpropyl)imidazolidin-4-one
CID 83257632
3-(2-methylpropyl)-2-propylimidazolidin-4-one
CID 83242214
3-butyl-2-ethylimidazolidin-4-one
CID 83238160
3-[2-(dimethylamino)ethyl]-2-ethylimidazolidin-4-one
CID 83250414
5-ethyl-3-(2-methyl-3-methylsulfanylpropyl)-2-propylimidazolidin-4-one
CID 83257307
3-(2-methyl-3-methylsulfanylpropyl)-2,5-dipropylimidazolidin-4-one
CID 83256965
2-ethyl-3-[2-[ethyl(methyl)amino]ethyl]imidazolidin-4-one
CID 83255041
3-(2-methylsulfanylethyl)-2-propylimidazolidin-4-one
CID 83257532
3-ethyl-1-(2-methyl-3-methylsulfanylpropyl)-6-propan-2-ylpiperazine-2,5-dione
CID 64972041
3-(3-ethoxypropyl)-2-ethylimidazolidin-4-one
CID 83236752

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-3-(2-methyl-3-methylsulfanylpropyl)imidazolidin-4-one?
The IUPAC name of 2-ethyl-3-(2-methyl-3-methylsulfanylpropyl)imidazolidin-4-one (CID 83258052) is 2-ethyl-3-(2-methyl-3-methylsulfanylpropyl)imidazolidin-4-one.
What is the SMILES notation for 2-ethyl-3-(2-methyl-3-methylsulfanylpropyl)imidazolidin-4-one?
The canonical SMILES for 2-ethyl-3-(2-methyl-3-methylsulfanylpropyl)imidazolidin-4-one is CCC1NCC(=O)N1CC(C)CSC.
What is the InChIKey of 2-ethyl-3-(2-methyl-3-methylsulfanylpropyl)imidazolidin-4-one?
The InChIKey is XAQLVVGYFFCTRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2OS/c1-4-9-11-5-10(13)12(9)6-8(2)7-14-3/h8-9,11H,4-7H2,1-3H3.
What are the key properties of 2-ethyl-3-(2-methyl-3-methylsulfanylpropyl)imidazolidin-4-one?
2-ethyl-3-(2-methyl-3-methylsulfanylpropyl)imidazolidin-4-one has a molecular weight of 216.35 g/mol, XLogP of 1.15, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-3-(2-methyl-3-methylsulfanylpropyl)imidazolidin-4-one is sourced from PubChem (CID 83258052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).