(4-methoxythiophen-2-yl)-(5-methyl-1-benzofuran-2-yl)methanol

C15H14O3S — CID 115836341

IUPAC(4-methoxythiophen-2-yl)-(5-methyl-1-benzofuran-2-yl)methanol
SMILESCOc1csc(C(O)c2cc3cc(C)ccc3o2)c1
InChIInChI=1S/C15H14O3S/c1-9-3-4-12-10(5-9)6-13(18-12)15(16)14-7-11(17-2)8-19-14/h3-8,15-16H,1-2H3
InChIKeyBGAHUKDFDYRZAY-UHFFFAOYSA-N
MW274.34 g/mol
LogP3.89
Rot. Bonds3

About (4-methoxythiophen-2-yl)-(5-methyl-1-benzofuran-2-yl)methanol

(4-methoxythiophen-2-yl)-(5-methyl-1-benzofuran-2-yl)methanol (PubChem CID 115836341) has the molecular formula C15H14O3S and a molecular weight of 274.34 g/mol. Its IUPAC name is (4-methoxythiophen-2-yl)-(5-methyl-1-benzofuran-2-yl)methanol.

Molecular Properties

Compound Name(4-methoxythiophen-2-yl)-(5-methyl-1-benzofuran-2-yl)methanol
PubChem CID115836341
Molecular FormulaC15H14O3S
Molecular Weight274.34 g/mol
Exact Mass274.07
IUPAC Name(4-methoxythiophen-2-yl)-(5-methyl-1-benzofuran-2-yl)methanol
SMILESCOc1csc(C(O)c2cc3cc(C)ccc3o2)c1
InChIInChI=1S/C15H14O3S/c1-9-3-4-12-10(5-9)6-13(18-12)15(16)14-7-11(17-2)8-19-14/h3-8,15-16H,1-2H3
InChIKeyBGAHUKDFDYRZAY-UHFFFAOYSA-N
XLogP3.89
TPSA42.60 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.34
LogP ≤ 53.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2-fluoro-5-methylphenyl)-(4-methoxythiophen-2-yl)methanol
CID 115794422
(4-bromo-5-methylthiophen-2-yl)-(5-methyl-1-benzofuran-2-yl)methanol
CID 102829575
1-benzothiophen-2-yl-(5-methyl-1-benzofuran-2-yl)methanol
CID 115836357
(3,6-dimethoxy-2-benzofuran-1-yl)-(5-methyl-1-benzofuran-2-yl)methanol;hydrate
CID 134122231
(4-methoxythiophen-2-yl)-(2,3,4,5,6-pentamethylphenyl)methanol
CID 81119806
(2,6-dimethylphenyl)-(5-methyl-1-benzofuran-2-yl)methanol
CID 114724628
2-ethyl-2-methoxy-1-(5-methyl-1-benzofuran-2-yl)butan-1-ol
CID 114727398
(4-methoxy-2-methylphenyl)-(4-methoxythiophen-2-yl)methanol
CID 81118539
(6-methoxynaphthalen-2-yl)-(4-methoxythiophen-2-yl)methanol
CID 81119910
(3,5-dimethoxyphenyl)-(4-methoxythiophen-2-yl)methanol
CID 115821638
(4-bromo-3,5-dimethylphenyl)-(5-methyl-1-benzofuran-2-yl)methanol
CID 114727481
furan-3-yl-(5-methyl-1-benzofuran-2-yl)methanol
CID 114723617

Frequently Asked Questions

What is the IUPAC name of (4-methoxythiophen-2-yl)-(5-methyl-1-benzofuran-2-yl)methanol?
The IUPAC name of (4-methoxythiophen-2-yl)-(5-methyl-1-benzofuran-2-yl)methanol (CID 115836341) is (4-methoxythiophen-2-yl)-(5-methyl-1-benzofuran-2-yl)methanol.
What is the SMILES notation for (4-methoxythiophen-2-yl)-(5-methyl-1-benzofuran-2-yl)methanol?
The canonical SMILES for (4-methoxythiophen-2-yl)-(5-methyl-1-benzofuran-2-yl)methanol is COc1csc(C(O)c2cc3cc(C)ccc3o2)c1.
What is the InChIKey of (4-methoxythiophen-2-yl)-(5-methyl-1-benzofuran-2-yl)methanol?
The InChIKey is BGAHUKDFDYRZAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14O3S/c1-9-3-4-12-10(5-9)6-13(18-12)15(16)14-7-11(17-2)8-19-14/h3-8,15-16H,1-2H3.
What are the key properties of (4-methoxythiophen-2-yl)-(5-methyl-1-benzofuran-2-yl)methanol?
(4-methoxythiophen-2-yl)-(5-methyl-1-benzofuran-2-yl)methanol has a molecular weight of 274.34 g/mol, XLogP of 3.89, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methoxythiophen-2-yl)-(5-methyl-1-benzofuran-2-yl)methanol is sourced from PubChem (CID 115836341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).