5-ethyl-3-(2-methyl-3-methylsulfanylpropyl)-2-propylimidazolidin-4-one

C13H26N2OS — CID 83257307

IUPAC5-ethyl-3-(2-methyl-3-methylsulfanylpropyl)-2-propylimidazolidin-4-one
SMILESCCCC1NC(CC)C(=O)N1CC(C)CSC
InChIInChI=1S/C13H26N2OS/c1-5-7-12-14-11(6-2)13(16)15(12)8-10(3)9-17-4/h10-12,14H,5-9H2,1-4H3
InChIKeyDYCRNICDIPLGFI-UHFFFAOYSA-N
MW258.43 g/mol
LogP2.32
Rot. Bonds7

About 5-ethyl-3-(2-methyl-3-methylsulfanylpropyl)-2-propylimidazolidin-4-one

5-ethyl-3-(2-methyl-3-methylsulfanylpropyl)-2-propylimidazolidin-4-one (PubChem CID 83257307) has the molecular formula C13H26N2OS and a molecular weight of 258.43 g/mol. Its IUPAC name is 5-ethyl-3-(2-methyl-3-methylsulfanylpropyl)-2-propylimidazolidin-4-one.

Molecular Properties

Compound Name5-ethyl-3-(2-methyl-3-methylsulfanylpropyl)-2-propylimidazolidin-4-one
PubChem CID83257307
Molecular FormulaC13H26N2OS
Molecular Weight258.43 g/mol
Exact Mass258.18
IUPAC Name5-ethyl-3-(2-methyl-3-methylsulfanylpropyl)-2-propylimidazolidin-4-one
SMILESCCCC1NC(CC)C(=O)N1CC(C)CSC
InChIInChI=1S/C13H26N2OS/c1-5-7-12-14-11(6-2)13(16)15(12)8-10(3)9-17-4/h10-12,14H,5-9H2,1-4H3
InChIKeyDYCRNICDIPLGFI-UHFFFAOYSA-N
XLogP2.32
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.43
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(2-methyl-3-methylsulfanylpropyl)-2,5-dipropylimidazolidin-4-one
CID 83256965
3-(2-methylpropyl)-2,5-dipropylimidazolidin-4-one
CID 83242304
5-butyl-2-methyl-3-(2-methyl-3-methylsulfanylpropyl)imidazolidin-4-one
CID 83257798
2-cyclopentyl-3-(2-methyl-3-methylsulfanylpropyl)-5-propylimidazolidin-4-one
CID 83256963
3-ethyl-1-(2-methyl-3-methylsulfanylpropyl)-6-propan-2-ylpiperazine-2,5-dione
CID 64972041
3-(2-methyl-3-methylsulfanylpropyl)-2-phenyl-5-propylimidazolidin-4-one
CID 83263712
3-(2-methyl-3-methylsulfanylpropyl)-5-propyl-2-thiophen-3-ylimidazolidin-4-one
CID 83257048
2-ethyl-5-propyl-3-(2,3,3-trimethylbutyl)imidazolidin-4-one
CID 83260860
3-(2-piperidin-1-ylpropyl)-2,5-dipropylimidazolidin-4-one
CID 83253294
5-benzyl-3-(2-methylpropyl)-2-propylimidazolidin-4-one
CID 83242743
2-ethyl-3-(2-methyl-3-methylsulfanylpropyl)imidazolidin-4-one
CID 83258052
1-(2-methyl-3-methylsulfanylpropyl)-3-propyl-1,4-diazepane-2,5-dione
CID 64972018

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-3-(2-methyl-3-methylsulfanylpropyl)-2-propylimidazolidin-4-one?
The IUPAC name of 5-ethyl-3-(2-methyl-3-methylsulfanylpropyl)-2-propylimidazolidin-4-one (CID 83257307) is 5-ethyl-3-(2-methyl-3-methylsulfanylpropyl)-2-propylimidazolidin-4-one.
What is the SMILES notation for 5-ethyl-3-(2-methyl-3-methylsulfanylpropyl)-2-propylimidazolidin-4-one?
The canonical SMILES for 5-ethyl-3-(2-methyl-3-methylsulfanylpropyl)-2-propylimidazolidin-4-one is CCCC1NC(CC)C(=O)N1CC(C)CSC.
What is the InChIKey of 5-ethyl-3-(2-methyl-3-methylsulfanylpropyl)-2-propylimidazolidin-4-one?
The InChIKey is DYCRNICDIPLGFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2OS/c1-5-7-12-14-11(6-2)13(16)15(12)8-10(3)9-17-4/h10-12,14H,5-9H2,1-4H3.
What are the key properties of 5-ethyl-3-(2-methyl-3-methylsulfanylpropyl)-2-propylimidazolidin-4-one?
5-ethyl-3-(2-methyl-3-methylsulfanylpropyl)-2-propylimidazolidin-4-one has a molecular weight of 258.43 g/mol, XLogP of 2.32, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-3-(2-methyl-3-methylsulfanylpropyl)-2-propylimidazolidin-4-one is sourced from PubChem (CID 83257307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).