1-[1-(4-thiophen-3-ylphenyl)ethyl]imidazole

C15H14N2S — CID 25099145

IUPAC1-[1-(4-thiophen-3-ylphenyl)ethyl]imidazole
SMILESCC(c1ccc(-c2ccsc2)cc1)n1ccnc1
InChIInChI=1S/C15H14N2S/c1-12(17-8-7-16-11-17)13-2-4-14(5-3-13)15-6-9-18-10-15/h2-12H,1H3
InChIKeyCPEUHVZSVWFLMC-UHFFFAOYSA-N
MW254.36 g/mol
LogP4.22
Rot. Bonds3

About 1-[1-(4-thiophen-3-ylphenyl)ethyl]imidazole

1-[1-(4-thiophen-3-ylphenyl)ethyl]imidazole (PubChem CID 25099145) has the molecular formula C15H14N2S and a molecular weight of 254.36 g/mol. Its IUPAC name is 1-[1-(4-thiophen-3-ylphenyl)ethyl]imidazole.

Molecular Properties

Compound Name1-[1-(4-thiophen-3-ylphenyl)ethyl]imidazole
PubChem CID25099145
Molecular FormulaC15H14N2S
Molecular Weight254.36 g/mol
Exact Mass254.09
IUPAC Name1-[1-(4-thiophen-3-ylphenyl)ethyl]imidazole
SMILESCC(c1ccc(-c2ccsc2)cc1)n1ccnc1
InChIInChI=1S/C15H14N2S/c1-12(17-8-7-16-11-17)13-2-4-14(5-3-13)15-6-9-18-10-15/h2-12H,1H3
InChIKeyCPEUHVZSVWFLMC-UHFFFAOYSA-N
XLogP4.22
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.36
LogP ≤ 54.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-[(4-methylphenyl)methyl]-4-(thiophen-3-yl)-1H-imidazole
CID 6539905
1-[1-(4-Thiophen-3-ylphenyl)propyl]imidazole
CID 25099144
4-(2-Thienyl)-1-(4-Methylbenzyl)-1h-Imidazole
CID 446185
1-{2-[(4E)-4,5,6,7-tetrahydro-1-benzothiophen-4-ylidene]ethyl}-1H-imidazole
CID 10489655
1-[2-(4,5,6,7-tetrahydro-1-benzothiophen-4-yl)ethyl]-1H-imidazole
CID 10847200
1-[(3-methylphenyl)methyl]-4-(thiophen-3-yl)-1H-imidazole
CID 6539907
N-butylsulfonyl-3-(4-imidazol-1-ylmethylphenyl)-5-iso-butylthiophene-2-sulfonamide
CID 10300357
1-[1-[4-(2-Chlorothiophen-3-yl)phenyl]propyl]imidazole
CID 44456181
1-[1-[2-Fluoro-4-(4-methylthiophen-3-yl)phenyl]propyl]imidazole
CID 44456221
1-[1-[4-(4-Methylthiophen-3-yl)phenyl]propyl]imidazole
CID 44456224
3-Imidazol-1-ylmethyl-2-thiophen-2-yl-pyridine
CID 57329793
5-(1-(1H-imidazol-1-yl)ethyl)-2-(thiophen-3-yl)pyridine
CID 57330005

Frequently Asked Questions

What is the IUPAC name of 1-[1-(4-thiophen-3-ylphenyl)ethyl]imidazole?
The IUPAC name of 1-[1-(4-thiophen-3-ylphenyl)ethyl]imidazole (CID 25099145) is 1-[1-(4-thiophen-3-ylphenyl)ethyl]imidazole.
What is the SMILES notation for 1-[1-(4-thiophen-3-ylphenyl)ethyl]imidazole?
The canonical SMILES for 1-[1-(4-thiophen-3-ylphenyl)ethyl]imidazole is CC(c1ccc(-c2ccsc2)cc1)n1ccnc1.
What is the InChIKey of 1-[1-(4-thiophen-3-ylphenyl)ethyl]imidazole?
The InChIKey is CPEUHVZSVWFLMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2S/c1-12(17-8-7-16-11-17)13-2-4-14(5-3-13)15-6-9-18-10-15/h2-12H,1H3.
What are the key properties of 1-[1-(4-thiophen-3-ylphenyl)ethyl]imidazole?
1-[1-(4-thiophen-3-ylphenyl)ethyl]imidazole has a molecular weight of 254.36 g/mol, XLogP of 4.22, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(4-thiophen-3-ylphenyl)ethyl]imidazole is sourced from PubChem (CID 25099145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).