1-[2-(1-ethylimidazol-2-yl)sulfanylpropanoyl]imidazolidin-2-one

C11H16N4O2S — CID 47137409

IUPAC1-[2-(1-ethylimidazol-2-yl)sulfanylpropanoyl]imidazolidin-2-one
SMILESCCn1ccnc1SC(C)C(=O)N1CCNC1=O
InChIInChI=1S/C11H16N4O2S/c1-3-14-6-4-13-11(14)18-8(2)9(16)15-7-5-12-10(15)17/h4,6,8H,3,5,7H2,1-2H3,(H,12,17)
InChIKeyLYFWPAICODOTKZ-UHFFFAOYSA-N
MW268.34 g/mol
LogP0.94
Rot. Bonds4

About 1-[2-(1-ethylimidazol-2-yl)sulfanylpropanoyl]imidazolidin-2-one

1-[2-(1-ethylimidazol-2-yl)sulfanylpropanoyl]imidazolidin-2-one (PubChem CID 47137409) has the molecular formula C11H16N4O2S and a molecular weight of 268.34 g/mol. Its IUPAC name is 1-[2-(1-ethylimidazol-2-yl)sulfanylpropanoyl]imidazolidin-2-one.

Molecular Properties

Compound Name1-[2-(1-ethylimidazol-2-yl)sulfanylpropanoyl]imidazolidin-2-one
PubChem CID47137409
Molecular FormulaC11H16N4O2S
Molecular Weight268.34 g/mol
Exact Mass268.10
IUPAC Name1-[2-(1-ethylimidazol-2-yl)sulfanylpropanoyl]imidazolidin-2-one
SMILESCCn1ccnc1SC(C)C(=O)N1CCNC1=O
InChIInChI=1S/C11H16N4O2S/c1-3-14-6-4-13-11(14)18-8(2)9(16)15-7-5-12-10(15)17/h4,6,8H,3,5,7H2,1-2H3,(H,12,17)
InChIKeyLYFWPAICODOTKZ-UHFFFAOYSA-N
XLogP0.94
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.34
LogP ≤ 50.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-[2-(1-ethylimidazol-2-yl)sulfanylpropanoyl]imidazolidin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[(2S)-2-[1-(3-chlorophenyl)imidazol-2-yl]sulfanylpropanoyl]imidazolidin-2-one
CID 41023424
1-[2-[1-(3-methylphenyl)imidazol-2-yl]sulfanylpropanoyl]imidazolidin-2-one
CID 51236326
1-(3,5-dimethylpiperidin-1-yl)-2-(1-ethylimidazol-2-yl)sulfanylpropan-1-one
CID 47138666
1-[(2S)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]propanoyl]imidazolidin-2-one
CID 8890258
2-[(2R)-1-oxo-1-(2-oxoimidazolidin-1-yl)propan-2-yl]sulfanyl-4-propyl-1H-pyrimidin-6-one
CID 136749109
1-ethyl-2-propan-2-ylsulfanylimidazole
CID 117189957
1-[(2R)-2-(2,5-difluorophenyl)sulfanylpropanoyl]imidazolidin-2-one
CID 9062916
1-(3,4-dimethoxyphenyl)-2-(1-ethylimidazol-2-yl)sulfanylpropan-1-one
CID 51099617
1-[2-[[5-(3,5-dimethylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]propanoyl]imidazolidin-2-one
CID 18092287
7-chloro-2-[(2R)-1-oxo-1-(2-oxoimidazolidin-1-yl)propan-2-yl]sulfanyl-3-propan-2-ylquinazolin-4-one
CID 8726531
1-[(2R)-2-[1-(3-chlorophenyl)tetrazol-5-yl]sulfanylpropanoyl]imidazolidin-2-one
CID 8861400
1-[2-[[4-methyl-5-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]propanoyl]imidazolidin-2-one
CID 18091672

Frequently Asked Questions

What is the IUPAC name of 1-[2-(1-ethylimidazol-2-yl)sulfanylpropanoyl]imidazolidin-2-one?
The IUPAC name of 1-[2-(1-ethylimidazol-2-yl)sulfanylpropanoyl]imidazolidin-2-one (CID 47137409) is 1-[2-(1-ethylimidazol-2-yl)sulfanylpropanoyl]imidazolidin-2-one.
What is the SMILES notation for 1-[2-(1-ethylimidazol-2-yl)sulfanylpropanoyl]imidazolidin-2-one?
The canonical SMILES for 1-[2-(1-ethylimidazol-2-yl)sulfanylpropanoyl]imidazolidin-2-one is CCn1ccnc1SC(C)C(=O)N1CCNC1=O.
What is the InChIKey of 1-[2-(1-ethylimidazol-2-yl)sulfanylpropanoyl]imidazolidin-2-one?
The InChIKey is LYFWPAICODOTKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O2S/c1-3-14-6-4-13-11(14)18-8(2)9(16)15-7-5-12-10(15)17/h4,6,8H,3,5,7H2,1-2H3,(H,12,17).
What are the key properties of 1-[2-(1-ethylimidazol-2-yl)sulfanylpropanoyl]imidazolidin-2-one?
1-[2-(1-ethylimidazol-2-yl)sulfanylpropanoyl]imidazolidin-2-one has a molecular weight of 268.34 g/mol, XLogP of 0.94, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(1-ethylimidazol-2-yl)sulfanylpropanoyl]imidazolidin-2-one is sourced from PubChem (CID 47137409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).