2-(5-methylthiophen-2-yl)-1-benzofuran

C13H10OS — CID 24744243

IUPAC2-(5-methylthiophen-2-yl)-1-benzofuran
SMILESCc1ccc(-c2cc3ccccc3o2)s1
InChIInChI=1S/C13H10OS/c1-9-6-7-13(15-9)12-8-10-4-2-3-5-11(10)14-12/h2-8H,1H3
InChIKeyMFJGNWUFULDPFW-UHFFFAOYSA-N
MW214.29 g/mol
LogP4.47
Rot. Bonds1

About 2-(5-methylthiophen-2-yl)-1-benzofuran

2-(5-methylthiophen-2-yl)-1-benzofuran (PubChem CID 24744243) has the molecular formula C13H10OS and a molecular weight of 214.29 g/mol. Its IUPAC name is 2-(5-methylthiophen-2-yl)-1-benzofuran.

Molecular Properties

Compound Name2-(5-methylthiophen-2-yl)-1-benzofuran
PubChem CID24744243
Molecular FormulaC13H10OS
Molecular Weight214.29 g/mol
Exact Mass214.05
IUPAC Name2-(5-methylthiophen-2-yl)-1-benzofuran
SMILESCc1ccc(-c2cc3ccccc3o2)s1
InChIInChI=1S/C13H10OS/c1-9-6-7-13(15-9)12-8-10-4-2-3-5-11(10)14-12/h2-8H,1H3
InChIKeyMFJGNWUFULDPFW-UHFFFAOYSA-N
XLogP4.47
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.29
LogP ≤ 54.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(5-methylthiophen-2-yl)-1-benzofuran?
The IUPAC name of 2-(5-methylthiophen-2-yl)-1-benzofuran (CID 24744243) is 2-(5-methylthiophen-2-yl)-1-benzofuran.
What is the SMILES notation for 2-(5-methylthiophen-2-yl)-1-benzofuran?
The canonical SMILES for 2-(5-methylthiophen-2-yl)-1-benzofuran is Cc1ccc(-c2cc3ccccc3o2)s1.
What is the InChIKey of 2-(5-methylthiophen-2-yl)-1-benzofuran?
The InChIKey is MFJGNWUFULDPFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10OS/c1-9-6-7-13(15-9)12-8-10-4-2-3-5-11(10)14-12/h2-8H,1H3.
What are the key properties of 2-(5-methylthiophen-2-yl)-1-benzofuran?
2-(5-methylthiophen-2-yl)-1-benzofuran has a molecular weight of 214.29 g/mol, XLogP of 4.47, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-methylthiophen-2-yl)-1-benzofuran is sourced from PubChem (CID 24744243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).