1-methyl-2-(3-thiophen-2-ylphenyl)imidazole

C14H12N2S — CID 59348191

IUPAC1-methyl-2-(3-thiophen-2-ylphenyl)imidazole
SMILESCn1ccnc1-c1cccc(-c2cccs2)c1
InChIInChI=1S/C14H12N2S/c1-16-8-7-15-14(16)12-5-2-4-11(10-12)13-6-3-9-17-13/h2-10H,1H3
InChIKeyYBGVDONILYDYAQ-UHFFFAOYSA-N
MW240.33 g/mol
LogP3.82
Rot. Bonds2

About 1-methyl-2-(3-thiophen-2-ylphenyl)imidazole

1-methyl-2-(3-thiophen-2-ylphenyl)imidazole (PubChem CID 59348191) has the molecular formula C14H12N2S and a molecular weight of 240.33 g/mol. Its IUPAC name is 1-methyl-2-(3-thiophen-2-ylphenyl)imidazole.

Molecular Properties

Compound Name1-methyl-2-(3-thiophen-2-ylphenyl)imidazole
PubChem CID59348191
Molecular FormulaC14H12N2S
Molecular Weight240.33 g/mol
Exact Mass240.07
IUPAC Name1-methyl-2-(3-thiophen-2-ylphenyl)imidazole
SMILESCn1ccnc1-c1cccc(-c2cccs2)c1
InChIInChI=1S/C14H12N2S/c1-16-8-7-15-14(16)12-5-2-4-11(10-12)13-6-3-9-17-13/h2-10H,1H3
InChIKeyYBGVDONILYDYAQ-UHFFFAOYSA-N
XLogP3.82
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.33
LogP ≤ 53.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-2-(3-thiophen-2-ylphenyl)imidazole?
The IUPAC name of 1-methyl-2-(3-thiophen-2-ylphenyl)imidazole (CID 59348191) is 1-methyl-2-(3-thiophen-2-ylphenyl)imidazole.
What is the SMILES notation for 1-methyl-2-(3-thiophen-2-ylphenyl)imidazole?
The canonical SMILES for 1-methyl-2-(3-thiophen-2-ylphenyl)imidazole is Cn1ccnc1-c1cccc(-c2cccs2)c1.
What is the InChIKey of 1-methyl-2-(3-thiophen-2-ylphenyl)imidazole?
The InChIKey is YBGVDONILYDYAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N2S/c1-16-8-7-15-14(16)12-5-2-4-11(10-12)13-6-3-9-17-13/h2-10H,1H3.
What are the key properties of 1-methyl-2-(3-thiophen-2-ylphenyl)imidazole?
1-methyl-2-(3-thiophen-2-ylphenyl)imidazole has a molecular weight of 240.33 g/mol, XLogP of 3.82, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2-(3-thiophen-2-ylphenyl)imidazole is sourced from PubChem (CID 59348191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).