1-(furan-3-yl)-2-(2-methoxy-5-methylphenyl)ethanol

C14H16O3 — CID 63895146

IUPAC1-(furan-3-yl)-2-(2-methoxy-5-methylphenyl)ethanol
SMILESCOc1ccc(C)cc1CC(O)c1ccoc1
InChIInChI=1S/C14H16O3/c1-10-3-4-14(16-2)12(7-10)8-13(15)11-5-6-17-9-11/h3-7,9,13,15H,8H2,1-2H3
InChIKeyOQHBXKUHWRMIPM-UHFFFAOYSA-N
MW232.28 g/mol
LogP2.87
Rot. Bonds4

About 1-(furan-3-yl)-2-(2-methoxy-5-methylphenyl)ethanol

1-(furan-3-yl)-2-(2-methoxy-5-methylphenyl)ethanol (PubChem CID 63895146) has the molecular formula C14H16O3 and a molecular weight of 232.28 g/mol. Its IUPAC name is 1-(furan-3-yl)-2-(2-methoxy-5-methylphenyl)ethanol.

Molecular Properties

Compound Name1-(furan-3-yl)-2-(2-methoxy-5-methylphenyl)ethanol
PubChem CID63895146
Molecular FormulaC14H16O3
Molecular Weight232.28 g/mol
Exact Mass232.11
IUPAC Name1-(furan-3-yl)-2-(2-methoxy-5-methylphenyl)ethanol
SMILESCOc1ccc(C)cc1CC(O)c1ccoc1
InChIInChI=1S/C14H16O3/c1-10-3-4-14(16-2)12(7-10)8-13(15)11-5-6-17-9-11/h3-7,9,13,15H,8H2,1-2H3
InChIKeyOQHBXKUHWRMIPM-UHFFFAOYSA-N
XLogP2.87
TPSA42.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.28
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1,2-bis(2-methoxy-5-methylphenyl)ethanol
CID 115781516
1-(3-fluoro-4-methoxyphenyl)-2-(2-methoxy-5-methylphenyl)ethanol
CID 65101453
1-(4-fluoro-3-methylphenyl)-2-(2-methoxy-5-methylphenyl)ethanol
CID 62160340
2-(2-methoxy-5-methylphenyl)-1-(6-methyl-3-pyridinyl)ethanol
CID 104822975
1-(5-bromothiophen-3-yl)-2-(2-methoxy-5-methylphenyl)ethanol
CID 105083533
2-(2-methoxy-5-methylphenyl)-1-(1-methylimidazol-4-yl)ethanol
CID 107978204
1-(3-bromo-5-chlorophenyl)-2-(2-methoxy-5-methylphenyl)ethanol
CID 107947332
1-(2,6-difluorophenyl)-2-(2-methoxy-5-methylphenyl)ethanol
CID 63895079
1-(5-bromo-2-methoxyphenyl)-2-(2-methoxy-5-methylphenyl)ethanol
CID 63894596
2-(2,5-dimethylphenyl)-1-(3-methoxy-4-methylphenyl)ethanol
CID 63018668
1-(2-aminophenyl)-2-(2-methoxy-5-methylphenyl)ethanol
CID 64833173
2-(2-methoxy-5-methylphenyl)-1-(1,3,5-trimethylpyrazol-4-yl)ethanol
CID 105083651

Frequently Asked Questions

What is the IUPAC name of 1-(furan-3-yl)-2-(2-methoxy-5-methylphenyl)ethanol?
The IUPAC name of 1-(furan-3-yl)-2-(2-methoxy-5-methylphenyl)ethanol (CID 63895146) is 1-(furan-3-yl)-2-(2-methoxy-5-methylphenyl)ethanol.
What is the SMILES notation for 1-(furan-3-yl)-2-(2-methoxy-5-methylphenyl)ethanol?
The canonical SMILES for 1-(furan-3-yl)-2-(2-methoxy-5-methylphenyl)ethanol is COc1ccc(C)cc1CC(O)c1ccoc1.
What is the InChIKey of 1-(furan-3-yl)-2-(2-methoxy-5-methylphenyl)ethanol?
The InChIKey is OQHBXKUHWRMIPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16O3/c1-10-3-4-14(16-2)12(7-10)8-13(15)11-5-6-17-9-11/h3-7,9,13,15H,8H2,1-2H3.
What are the key properties of 1-(furan-3-yl)-2-(2-methoxy-5-methylphenyl)ethanol?
1-(furan-3-yl)-2-(2-methoxy-5-methylphenyl)ethanol has a molecular weight of 232.28 g/mol, XLogP of 2.87, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(furan-3-yl)-2-(2-methoxy-5-methylphenyl)ethanol is sourced from PubChem (CID 63895146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).