2-(3-fluorophenyl)-1-(5-methyl-1-benzofuran-2-yl)ethanol

C17H15FO2 — CID 63016416

IUPAC2-(3-fluorophenyl)-1-(5-methyl-1-benzofuran-2-yl)ethanol
SMILESCc1ccc2oc(C(O)Cc3cccc(F)c3)cc2c1
InChIInChI=1S/C17H15FO2/c1-11-5-6-16-13(7-11)10-17(20-16)15(19)9-12-3-2-4-14(18)8-12/h2-8,10,15,19H,9H2,1H3
InChIKeyWIBBMQIQYMJYCU-UHFFFAOYSA-N
MW270.30 g/mol
LogP4.16
Rot. Bonds3

About 2-(3-fluorophenyl)-1-(5-methyl-1-benzofuran-2-yl)ethanol

2-(3-fluorophenyl)-1-(5-methyl-1-benzofuran-2-yl)ethanol (PubChem CID 63016416) has the molecular formula C17H15FO2 and a molecular weight of 270.30 g/mol. Its IUPAC name is 2-(3-fluorophenyl)-1-(5-methyl-1-benzofuran-2-yl)ethanol.

Molecular Properties

Compound Name2-(3-fluorophenyl)-1-(5-methyl-1-benzofuran-2-yl)ethanol
PubChem CID63016416
Molecular FormulaC17H15FO2
Molecular Weight270.30 g/mol
Exact Mass270.11
IUPAC Name2-(3-fluorophenyl)-1-(5-methyl-1-benzofuran-2-yl)ethanol
SMILESCc1ccc2oc(C(O)Cc3cccc(F)c3)cc2c1
InChIInChI=1S/C17H15FO2/c1-11-5-6-16-13(7-11)10-17(20-16)15(19)9-12-3-2-4-14(18)8-12/h2-8,10,15,19H,9H2,1H3
InChIKeyWIBBMQIQYMJYCU-UHFFFAOYSA-N
XLogP4.16
TPSA33.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.30
LogP ≤ 54.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3,5-dimethylphenyl)-1-(5-methyl-1-benzofuran-2-yl)ethanol
CID 114726442
2-(3,4-dimethylphenyl)-1-(5-methyl-1-benzofuran-2-yl)ethanol
CID 63017844
2-(2-chloro-6-fluorophenyl)-1-(5-methyl-1-benzofuran-2-yl)ethanol
CID 63016559
2-(5-chloro-2-fluorophenyl)-1-(5-methyl-1-benzofuran-2-yl)ethanol
CID 103053486
2-(4-fluorophenyl)sulfanyl-1-(5-methyl-1-benzofuran-2-yl)ethanol
CID 114726766
2-(3-fluorophenyl)sulfanyl-1-(5-methyl-1-benzofuran-2-yl)ethanamine
CID 114729395
5,5,5-trifluoro-1-(5-methyl-1-benzofuran-2-yl)pentan-1-ol
CID 105120593
1-(3-fluorophenyl)-N-methyl-1-(5-methyl-1-benzofuran-2-yl)methanamine
CID 114727544
2-(3-fluorophenyl)-1-(2,4,5-trimethylfuran-3-yl)ethanol
CID 65152206
(5-fluoro-2-methylphenyl)-(5-methyl-1-benzofuran-2-yl)methanol
CID 114726422
1-(5-fluoro-1-benzofuran-2-yl)-2-(2-fluorophenyl)ethanol
CID 114726361
(3-fluoro-5-methylphenyl)-(5-methyl-1-benzofuran-2-yl)methanol
CID 114727112

Frequently Asked Questions

What is the IUPAC name of 2-(3-fluorophenyl)-1-(5-methyl-1-benzofuran-2-yl)ethanol?
The IUPAC name of 2-(3-fluorophenyl)-1-(5-methyl-1-benzofuran-2-yl)ethanol (CID 63016416) is 2-(3-fluorophenyl)-1-(5-methyl-1-benzofuran-2-yl)ethanol.
What is the SMILES notation for 2-(3-fluorophenyl)-1-(5-methyl-1-benzofuran-2-yl)ethanol?
The canonical SMILES for 2-(3-fluorophenyl)-1-(5-methyl-1-benzofuran-2-yl)ethanol is Cc1ccc2oc(C(O)Cc3cccc(F)c3)cc2c1.
What is the InChIKey of 2-(3-fluorophenyl)-1-(5-methyl-1-benzofuran-2-yl)ethanol?
The InChIKey is WIBBMQIQYMJYCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15FO2/c1-11-5-6-16-13(7-11)10-17(20-16)15(19)9-12-3-2-4-14(18)8-12/h2-8,10,15,19H,9H2,1H3.
What are the key properties of 2-(3-fluorophenyl)-1-(5-methyl-1-benzofuran-2-yl)ethanol?
2-(3-fluorophenyl)-1-(5-methyl-1-benzofuran-2-yl)ethanol has a molecular weight of 270.30 g/mol, XLogP of 4.16, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluorophenyl)-1-(5-methyl-1-benzofuran-2-yl)ethanol is sourced from PubChem (CID 63016416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).