(5-bromo-4-methylthiophen-2-yl)-(3-methylfuran-2-yl)methanol

C11H11BrO2S — CID 79991143

IUPAC(5-bromo-4-methylthiophen-2-yl)-(3-methylfuran-2-yl)methanol
SMILESCc1ccoc1C(O)c1cc(C)c(Br)s1
InChIInChI=1S/C11H11BrO2S/c1-6-3-4-14-10(6)9(13)8-5-7(2)11(12)15-8/h3-5,9,13H,1-2H3
InChIKeyGBHZXIVRMRNCSX-UHFFFAOYSA-N
MW287.18 g/mol
LogP3.80
Rot. Bonds2

About (5-bromo-4-methylthiophen-2-yl)-(3-methylfuran-2-yl)methanol

(5-bromo-4-methylthiophen-2-yl)-(3-methylfuran-2-yl)methanol (PubChem CID 79991143) has the molecular formula C11H11BrO2S and a molecular weight of 287.18 g/mol. Its IUPAC name is (5-bromo-4-methylthiophen-2-yl)-(3-methylfuran-2-yl)methanol.

Molecular Properties

Compound Name(5-bromo-4-methylthiophen-2-yl)-(3-methylfuran-2-yl)methanol
PubChem CID79991143
Molecular FormulaC11H11BrO2S
Molecular Weight287.18 g/mol
Exact Mass285.97
IUPAC Name(5-bromo-4-methylthiophen-2-yl)-(3-methylfuran-2-yl)methanol
SMILESCc1ccoc1C(O)c1cc(C)c(Br)s1
InChIInChI=1S/C11H11BrO2S/c1-6-3-4-14-10(6)9(13)8-5-7(2)11(12)15-8/h3-5,9,13H,1-2H3
InChIKeyGBHZXIVRMRNCSX-UHFFFAOYSA-N
XLogP3.80
TPSA33.37 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.18
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(4,5-dibromothiophen-2-yl)-(3-methylfuran-2-yl)methanol
CID 80535252
(5-bromothiophen-2-yl)-(3-methylfuran-2-yl)methanol
CID 61081936
(3-bromofuran-2-yl)-(4,5-dibromothiophen-2-yl)methanol
CID 115800624
(5-bromo-4-methylthiophen-2-yl)-(2,3,5,6-tetramethylphenyl)methanol
CID 79996997
(4-bromo-1,3-thiazol-2-yl)-(3-methylfuran-2-yl)methanol
CID 114684488
2-[bromo-(5-chloro-4-methylthiophen-2-yl)methyl]-3-methylfuran
CID 102765077
(5-bromo-4-methylthiophen-2-yl)-(3-methylphenyl)methanol
CID 79991362
(3-methylfuran-2-yl)-(2,3,5,6-tetramethylphenyl)methanol
CID 61089048
(5-bromo-4-methylthiophen-2-yl)-(5-bromothiophen-3-yl)methanol
CID 107964321
(5-bromo-4-methylthiophen-2-yl)-(4-phenylphenyl)methanol
CID 79998991
(2-bromofuran-3-yl)-(5-bromo-4-methylthiophen-2-yl)methanamine
CID 106851869
(5-bromo-4-methylthiophen-2-yl)-(4-chloro-2-fluorophenyl)methanol
CID 79992530

Frequently Asked Questions

What is the IUPAC name of (5-bromo-4-methylthiophen-2-yl)-(3-methylfuran-2-yl)methanol?
The IUPAC name of (5-bromo-4-methylthiophen-2-yl)-(3-methylfuran-2-yl)methanol (CID 79991143) is (5-bromo-4-methylthiophen-2-yl)-(3-methylfuran-2-yl)methanol.
What is the SMILES notation for (5-bromo-4-methylthiophen-2-yl)-(3-methylfuran-2-yl)methanol?
The canonical SMILES for (5-bromo-4-methylthiophen-2-yl)-(3-methylfuran-2-yl)methanol is Cc1ccoc1C(O)c1cc(C)c(Br)s1.
What is the InChIKey of (5-bromo-4-methylthiophen-2-yl)-(3-methylfuran-2-yl)methanol?
The InChIKey is GBHZXIVRMRNCSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11BrO2S/c1-6-3-4-14-10(6)9(13)8-5-7(2)11(12)15-8/h3-5,9,13H,1-2H3.
What are the key properties of (5-bromo-4-methylthiophen-2-yl)-(3-methylfuran-2-yl)methanol?
(5-bromo-4-methylthiophen-2-yl)-(3-methylfuran-2-yl)methanol has a molecular weight of 287.18 g/mol, XLogP of 3.80, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-bromo-4-methylthiophen-2-yl)-(3-methylfuran-2-yl)methanol is sourced from PubChem (CID 79991143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).