3-benzyl-2-thiophen-2-ylimidazo[1,2-a]pyridine

C18H14N2S — CID 56933914

IUPAC3-benzyl-2-thiophen-2-ylimidazo[1,2-a]pyridine
SMILESc1ccc(Cc2c(-c3cccs3)nc3ccccn23)cc1
InChIInChI=1S/C18H14N2S/c1-2-7-14(8-3-1)13-15-18(16-9-6-12-21-16)19-17-10-4-5-11-20(15)17/h1-12H,13H2
InChIKeyAZTNTGCRWQNYHJ-UHFFFAOYSA-N
MW290.39 g/mol
LogP4.65
Rot. Bonds3

About 3-benzyl-2-thiophen-2-ylimidazo[1,2-a]pyridine

3-benzyl-2-thiophen-2-ylimidazo[1,2-a]pyridine (PubChem CID 56933914) has the molecular formula C18H14N2S and a molecular weight of 290.39 g/mol. Its IUPAC name is 3-benzyl-2-thiophen-2-ylimidazo[1,2-a]pyridine.

Molecular Properties

Compound Name3-benzyl-2-thiophen-2-ylimidazo[1,2-a]pyridine
PubChem CID56933914
Molecular FormulaC18H14N2S
Molecular Weight290.39 g/mol
Exact Mass290.09
IUPAC Name3-benzyl-2-thiophen-2-ylimidazo[1,2-a]pyridine
SMILESc1ccc(Cc2c(-c3cccs3)nc3ccccn23)cc1
InChIInChI=1S/C18H14N2S/c1-2-7-14(8-3-1)13-15-18(16-9-6-12-21-16)19-17-10-4-5-11-20(15)17/h1-12H,13H2
InChIKeyAZTNTGCRWQNYHJ-UHFFFAOYSA-N
XLogP4.65
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.39
LogP ≤ 54.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-benzyl-2-thiophen-2-ylimidazo[1,2-a]pyridine?
The IUPAC name of 3-benzyl-2-thiophen-2-ylimidazo[1,2-a]pyridine (CID 56933914) is 3-benzyl-2-thiophen-2-ylimidazo[1,2-a]pyridine.
What is the SMILES notation for 3-benzyl-2-thiophen-2-ylimidazo[1,2-a]pyridine?
The canonical SMILES for 3-benzyl-2-thiophen-2-ylimidazo[1,2-a]pyridine is c1ccc(Cc2c(-c3cccs3)nc3ccccn23)cc1.
What is the InChIKey of 3-benzyl-2-thiophen-2-ylimidazo[1,2-a]pyridine?
The InChIKey is AZTNTGCRWQNYHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14N2S/c1-2-7-14(8-3-1)13-15-18(16-9-6-12-21-16)19-17-10-4-5-11-20(15)17/h1-12H,13H2.
What are the key properties of 3-benzyl-2-thiophen-2-ylimidazo[1,2-a]pyridine?
3-benzyl-2-thiophen-2-ylimidazo[1,2-a]pyridine has a molecular weight of 290.39 g/mol, XLogP of 4.65, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-benzyl-2-thiophen-2-ylimidazo[1,2-a]pyridine is sourced from PubChem (CID 56933914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).