2-[2-(2-thiophen-3-ylphenyl)ethyl]-4,5-dihydro-1H-imidazole

C15H16N2S — CID 25034503

IUPAC2-[2-(2-thiophen-3-ylphenyl)ethyl]-4,5-dihydro-1H-imidazole
SMILESc1ccc(-c2ccsc2)c(CCC2=NCCN2)c1
InChIInChI=1S/C15H16N2S/c1-2-4-14(13-7-10-18-11-13)12(3-1)5-6-15-16-8-9-17-15/h1-4,7,10-11H,5-6,8-9H2,(H,16,17)
InChIKeyRIQDHWHYIBBKAO-UHFFFAOYSA-N
MW256.37 g/mol
LogP3.35
Rot. Bonds4

About 2-[2-(2-thiophen-3-ylphenyl)ethyl]-4,5-dihydro-1H-imidazole

2-[2-(2-thiophen-3-ylphenyl)ethyl]-4,5-dihydro-1H-imidazole (PubChem CID 25034503) has the molecular formula C15H16N2S and a molecular weight of 256.37 g/mol. Its IUPAC name is 2-[2-(2-thiophen-3-ylphenyl)ethyl]-4,5-dihydro-1H-imidazole.

Molecular Properties

Compound Name2-[2-(2-thiophen-3-ylphenyl)ethyl]-4,5-dihydro-1H-imidazole
PubChem CID25034503
Molecular FormulaC15H16N2S
Molecular Weight256.37 g/mol
Exact Mass256.10
IUPAC Name2-[2-(2-thiophen-3-ylphenyl)ethyl]-4,5-dihydro-1H-imidazole
SMILESc1ccc(-c2ccsc2)c(CCC2=NCCN2)c1
InChIInChI=1S/C15H16N2S/c1-2-4-14(13-7-10-18-11-13)12(3-1)5-6-15-16-8-9-17-15/h1-4,7,10-11H,5-6,8-9H2,(H,16,17)
InChIKeyRIQDHWHYIBBKAO-UHFFFAOYSA-N
XLogP3.35
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.37
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[2-(2-thiophen-3-ylphenyl)ethyl]-4,5-dihydro-1H-imidazole with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-thiophen-3-ylphenyl)ethyl]-4,5-dihydro-1H-imidazole?
The IUPAC name of 2-[2-(2-thiophen-3-ylphenyl)ethyl]-4,5-dihydro-1H-imidazole (CID 25034503) is 2-[2-(2-thiophen-3-ylphenyl)ethyl]-4,5-dihydro-1H-imidazole.
What is the SMILES notation for 2-[2-(2-thiophen-3-ylphenyl)ethyl]-4,5-dihydro-1H-imidazole?
The canonical SMILES for 2-[2-(2-thiophen-3-ylphenyl)ethyl]-4,5-dihydro-1H-imidazole is c1ccc(-c2ccsc2)c(CCC2=NCCN2)c1.
What is the InChIKey of 2-[2-(2-thiophen-3-ylphenyl)ethyl]-4,5-dihydro-1H-imidazole?
The InChIKey is RIQDHWHYIBBKAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2S/c1-2-4-14(13-7-10-18-11-13)12(3-1)5-6-15-16-8-9-17-15/h1-4,7,10-11H,5-6,8-9H2,(H,16,17).
What are the key properties of 2-[2-(2-thiophen-3-ylphenyl)ethyl]-4,5-dihydro-1H-imidazole?
2-[2-(2-thiophen-3-ylphenyl)ethyl]-4,5-dihydro-1H-imidazole has a molecular weight of 256.37 g/mol, XLogP of 3.35, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-thiophen-3-ylphenyl)ethyl]-4,5-dihydro-1H-imidazole is sourced from PubChem (CID 25034503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).