1-(2-methylsulfonylethyl)-2-(3-methylthiophen-2-yl)imidazole

C11H14N2O2S2 — CID 56912209

IUPAC1-(2-methylsulfonylethyl)-2-(3-methylthiophen-2-yl)imidazole
SMILESCc1ccsc1-c1nccn1CCS(C)(=O)=O
InChIInChI=1S/C11H14N2O2S2/c1-9-3-7-16-10(9)11-12-4-5-13(11)6-8-17(2,14)15/h3-5,7H,6,8H2,1-2H3
InChIKeyGBBKQMASHKXTCV-UHFFFAOYSA-N
MW270.38 g/mol
LogP1.96
Rot. Bonds4

About 1-(2-methylsulfonylethyl)-2-(3-methylthiophen-2-yl)imidazole

1-(2-methylsulfonylethyl)-2-(3-methylthiophen-2-yl)imidazole (PubChem CID 56912209) has the molecular formula C11H14N2O2S2 and a molecular weight of 270.38 g/mol. Its IUPAC name is 1-(2-methylsulfonylethyl)-2-(3-methylthiophen-2-yl)imidazole.

Molecular Properties

Compound Name1-(2-methylsulfonylethyl)-2-(3-methylthiophen-2-yl)imidazole
PubChem CID56912209
Molecular FormulaC11H14N2O2S2
Molecular Weight270.38 g/mol
Exact Mass270.05
IUPAC Name1-(2-methylsulfonylethyl)-2-(3-methylthiophen-2-yl)imidazole
SMILESCc1ccsc1-c1nccn1CCS(C)(=O)=O
InChIInChI=1S/C11H14N2O2S2/c1-9-3-7-16-10(9)11-12-4-5-13(11)6-8-17(2,14)15/h3-5,7H,6,8H2,1-2H3
InChIKeyGBBKQMASHKXTCV-UHFFFAOYSA-N
XLogP1.96
TPSA51.96 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.38
LogP ≤ 51.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 1-(2-methylsulfonylethyl)-2-(3-methylthiophen-2-yl)imidazole 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-(2-methylsulfonylethyl)-2-thiophen-2-ylimidazole
CID 75432637
1-methyl-2-[1-(2-methylsulfonylethyl)imidazol-2-yl]imidazole
CID 56889384
(2R)-1-[2-(3-methylthiophen-2-yl)imidazol-1-yl]butan-2-ol
CID 95126697
(2S)-1-[2-(3-methylthiophen-2-yl)imidazol-1-yl]butan-2-ol
CID 95126696
2-(3-iodophenyl)-1-(2-methylsulfonylethyl)imidazole
CID 79788339
1-(2-propan-2-ylsulfonylethyl)-2-thiophen-2-ylimidazole
CID 106731651
2-methyl-1-(3-methylsulfonylpropyl)imidazole
CID 63239256
5-[[2-(3-methylthiophen-2-yl)imidazol-1-yl]methyl]-1-phenyltetrazole
CID 70718630
3-[[2-(3-methylthiophen-2-yl)imidazol-1-yl]methyl]-6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazole
CID 56869815
8-methoxy-2-[1-(2-methylsulfonylethyl)imidazol-2-yl]quinoline
CID 56910045
N-methyl-1-[(3-methylthiophen-2-yl)methyl]imidazol-2-amine
CID 106577983
3-[1-(3-methylsulfonylpropyl)imidazol-2-yl]aniline
CID 63191637

Frequently Asked Questions

What is the IUPAC name of 1-(2-methylsulfonylethyl)-2-(3-methylthiophen-2-yl)imidazole?
The IUPAC name of 1-(2-methylsulfonylethyl)-2-(3-methylthiophen-2-yl)imidazole (CID 56912209) is 1-(2-methylsulfonylethyl)-2-(3-methylthiophen-2-yl)imidazole.
What is the SMILES notation for 1-(2-methylsulfonylethyl)-2-(3-methylthiophen-2-yl)imidazole?
The canonical SMILES for 1-(2-methylsulfonylethyl)-2-(3-methylthiophen-2-yl)imidazole is Cc1ccsc1-c1nccn1CCS(C)(=O)=O.
What is the InChIKey of 1-(2-methylsulfonylethyl)-2-(3-methylthiophen-2-yl)imidazole?
The InChIKey is GBBKQMASHKXTCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O2S2/c1-9-3-7-16-10(9)11-12-4-5-13(11)6-8-17(2,14)15/h3-5,7H,6,8H2,1-2H3.
What are the key properties of 1-(2-methylsulfonylethyl)-2-(3-methylthiophen-2-yl)imidazole?
1-(2-methylsulfonylethyl)-2-(3-methylthiophen-2-yl)imidazole has a molecular weight of 270.38 g/mol, XLogP of 1.96, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylsulfonylethyl)-2-(3-methylthiophen-2-yl)imidazole is sourced from PubChem (CID 56912209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).