5-(furan-2-yl)-4-(1H-pyrrol-2-yl)-2-thiophen-2-yl-1H-imidazole

C15H11N3OS — CID 141081058

IUPAC5-(furan-2-yl)-4-(1H-pyrrol-2-yl)-2-thiophen-2-yl-1H-imidazole
SMILESc1c[nH]c(-c2nc(-c3cccs3)[nH]c2-c2ccco2)c1
InChIInChI=1S/C15H11N3OS/c1-4-10(16-7-1)13-14(11-5-2-8-19-11)18-15(17-13)12-6-3-9-20-12/h1-9,16H,(H,17,18)
InChIKeyKFFPDCFRQXISJT-UHFFFAOYSA-N
MW281.34 g/mol
LogP4.39
Rot. Bonds3

About 5-(furan-2-yl)-4-(1H-pyrrol-2-yl)-2-thiophen-2-yl-1H-imidazole

5-(furan-2-yl)-4-(1H-pyrrol-2-yl)-2-thiophen-2-yl-1H-imidazole (PubChem CID 141081058) has the molecular formula C15H11N3OS and a molecular weight of 281.34 g/mol. Its IUPAC name is 5-(furan-2-yl)-4-(1H-pyrrol-2-yl)-2-thiophen-2-yl-1H-imidazole.

Molecular Properties

Compound Name5-(furan-2-yl)-4-(1H-pyrrol-2-yl)-2-thiophen-2-yl-1H-imidazole
PubChem CID141081058
Molecular FormulaC15H11N3OS
Molecular Weight281.34 g/mol
Exact Mass281.06
IUPAC Name5-(furan-2-yl)-4-(1H-pyrrol-2-yl)-2-thiophen-2-yl-1H-imidazole
SMILESc1c[nH]c(-c2nc(-c3cccs3)[nH]c2-c2ccco2)c1
InChIInChI=1S/C15H11N3OS/c1-4-10(16-7-1)13-14(11-5-2-8-19-11)18-15(17-13)12-6-3-9-20-12/h1-9,16H,(H,17,18)
InChIKeyKFFPDCFRQXISJT-UHFFFAOYSA-N
XLogP4.39
TPSA57.61 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.34
LogP ≤ 54.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(furan-2-yl)-4-(1H-pyrrol-2-yl)-2-thiophen-2-yl-1H-imidazole?
The IUPAC name of 5-(furan-2-yl)-4-(1H-pyrrol-2-yl)-2-thiophen-2-yl-1H-imidazole (CID 141081058) is 5-(furan-2-yl)-4-(1H-pyrrol-2-yl)-2-thiophen-2-yl-1H-imidazole.
What is the SMILES notation for 5-(furan-2-yl)-4-(1H-pyrrol-2-yl)-2-thiophen-2-yl-1H-imidazole?
The canonical SMILES for 5-(furan-2-yl)-4-(1H-pyrrol-2-yl)-2-thiophen-2-yl-1H-imidazole is c1c[nH]c(-c2nc(-c3cccs3)[nH]c2-c2ccco2)c1.
What is the InChIKey of 5-(furan-2-yl)-4-(1H-pyrrol-2-yl)-2-thiophen-2-yl-1H-imidazole?
The InChIKey is KFFPDCFRQXISJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11N3OS/c1-4-10(16-7-1)13-14(11-5-2-8-19-11)18-15(17-13)12-6-3-9-20-12/h1-9,16H,(H,17,18).
What are the key properties of 5-(furan-2-yl)-4-(1H-pyrrol-2-yl)-2-thiophen-2-yl-1H-imidazole?
5-(furan-2-yl)-4-(1H-pyrrol-2-yl)-2-thiophen-2-yl-1H-imidazole has a molecular weight of 281.34 g/mol, XLogP of 4.39, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(furan-2-yl)-4-(1H-pyrrol-2-yl)-2-thiophen-2-yl-1H-imidazole is sourced from PubChem (CID 141081058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).