1-phenyl-5-thiophen-2-ylimidazole

C13H10N2S — CID 11413496

IUPAC1-phenyl-5-thiophen-2-ylimidazole
SMILESc1ccc(-n2cncc2-c2cccs2)cc1
InChIInChI=1S/C13H10N2S/c1-2-5-11(6-3-1)15-10-14-9-12(15)13-7-4-8-16-13/h1-10H
InChIKeyHLHZTAQPIIXZBQ-UHFFFAOYSA-N
MW226.30 g/mol
LogP3.60
Rot. Bonds2

About 1-phenyl-5-thiophen-2-ylimidazole

1-phenyl-5-thiophen-2-ylimidazole (PubChem CID 11413496) has the molecular formula C13H10N2S and a molecular weight of 226.30 g/mol. Its IUPAC name is 1-phenyl-5-thiophen-2-ylimidazole.

Molecular Properties

Compound Name1-phenyl-5-thiophen-2-ylimidazole
PubChem CID11413496
Molecular FormulaC13H10N2S
Molecular Weight226.30 g/mol
Exact Mass226.06
IUPAC Name1-phenyl-5-thiophen-2-ylimidazole
SMILESc1ccc(-n2cncc2-c2cccs2)cc1
InChIInChI=1S/C13H10N2S/c1-2-5-11(6-3-1)15-10-14-9-12(15)13-7-4-8-16-13/h1-10H
InChIKeyHLHZTAQPIIXZBQ-UHFFFAOYSA-N
XLogP3.60
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.30
LogP ≤ 53.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-phenyl-5-thiophen-2-ylimidazole?
The IUPAC name of 1-phenyl-5-thiophen-2-ylimidazole (CID 11413496) is 1-phenyl-5-thiophen-2-ylimidazole.
What is the SMILES notation for 1-phenyl-5-thiophen-2-ylimidazole?
The canonical SMILES for 1-phenyl-5-thiophen-2-ylimidazole is c1ccc(-n2cncc2-c2cccs2)cc1.
What is the InChIKey of 1-phenyl-5-thiophen-2-ylimidazole?
The InChIKey is HLHZTAQPIIXZBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10N2S/c1-2-5-11(6-3-1)15-10-14-9-12(15)13-7-4-8-16-13/h1-10H.
What are the key properties of 1-phenyl-5-thiophen-2-ylimidazole?
1-phenyl-5-thiophen-2-ylimidazole has a molecular weight of 226.30 g/mol, XLogP of 3.60, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-5-thiophen-2-ylimidazole is sourced from PubChem (CID 11413496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).