2-(2-fluoro-3-methoxyphenyl)-1-(4-methylphenyl)ethanol

C16H17FO2 — CID 104793076

IUPAC2-(2-fluoro-3-methoxyphenyl)-1-(4-methylphenyl)ethanol
SMILESCOc1cccc(CC(O)c2ccc(C)cc2)c1F
InChIInChI=1S/C16H17FO2/c1-11-6-8-12(9-7-11)14(18)10-13-4-3-5-15(19-2)16(13)17/h3-9,14,18H,10H2,1-2H3
InChIKeyZRFYLTVWODTQLY-UHFFFAOYSA-N
MW260.31 g/mol
LogP3.42
Rot. Bonds4

About 2-(2-fluoro-3-methoxyphenyl)-1-(4-methylphenyl)ethanol

2-(2-fluoro-3-methoxyphenyl)-1-(4-methylphenyl)ethanol (PubChem CID 104793076) has the molecular formula C16H17FO2 and a molecular weight of 260.31 g/mol. Its IUPAC name is 2-(2-fluoro-3-methoxyphenyl)-1-(4-methylphenyl)ethanol.

Molecular Properties

Compound Name2-(2-fluoro-3-methoxyphenyl)-1-(4-methylphenyl)ethanol
PubChem CID104793076
Molecular FormulaC16H17FO2
Molecular Weight260.31 g/mol
Exact Mass260.12
IUPAC Name2-(2-fluoro-3-methoxyphenyl)-1-(4-methylphenyl)ethanol
SMILESCOc1cccc(CC(O)c2ccc(C)cc2)c1F
InChIInChI=1S/C16H17FO2/c1-11-6-8-12(9-7-11)14(18)10-13-4-3-5-15(19-2)16(13)17/h3-9,14,18H,10H2,1-2H3
InChIKeyZRFYLTVWODTQLY-UHFFFAOYSA-N
XLogP3.42
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.31
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-aminophenyl)-2-(2-fluoro-3-methoxyphenyl)ethanol
CID 106695530
2-(2-fluoro-3-methoxyphenyl)-1-(4-fluoro-3-methoxyphenyl)ethanol
CID 115832675
2-(2-fluoro-3-methoxyphenyl)-1-(5-methyl-2-pyridinyl)ethanol
CID 104793222
3-(2-fluoro-3-methoxyphenyl)-N-methyl-2-(4-methylphenyl)propan-1-amine
CID 104794718
2-(2-fluoro-3-methoxyphenyl)-1-[3-(methoxymethyl)phenyl]ethanol
CID 104793170
2-(2-fluoro-3-methoxyphenyl)-1-pyrimidin-2-ylethanol
CID 104793572
2-(2-fluoro-3-methoxyphenyl)-1-(2,3,4-trifluorophenyl)ethanol
CID 115832717
1,1,1-trifluoro-3-(2-fluoro-3-methoxyphenyl)propan-2-ol
CID 104793601
1-[4-(difluoromethyl)phenyl]-2-(2-methoxyphenyl)ethanol
CID 115524903
1-(2-bromo-3-fluorophenyl)-2-(2-fluoro-3-methoxyphenyl)ethanol
CID 115832698
2-(3-chloro-2-fluorophenyl)-1-(3-methoxy-4-methylphenyl)ethanol
CID 102867481
2-(2-fluoro-3-methoxyphenyl)-1-(2-methylpyrimidin-4-yl)ethanol
CID 104793243

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluoro-3-methoxyphenyl)-1-(4-methylphenyl)ethanol?
The IUPAC name of 2-(2-fluoro-3-methoxyphenyl)-1-(4-methylphenyl)ethanol (CID 104793076) is 2-(2-fluoro-3-methoxyphenyl)-1-(4-methylphenyl)ethanol.
What is the SMILES notation for 2-(2-fluoro-3-methoxyphenyl)-1-(4-methylphenyl)ethanol?
The canonical SMILES for 2-(2-fluoro-3-methoxyphenyl)-1-(4-methylphenyl)ethanol is COc1cccc(CC(O)c2ccc(C)cc2)c1F.
What is the InChIKey of 2-(2-fluoro-3-methoxyphenyl)-1-(4-methylphenyl)ethanol?
The InChIKey is ZRFYLTVWODTQLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17FO2/c1-11-6-8-12(9-7-11)14(18)10-13-4-3-5-15(19-2)16(13)17/h3-9,14,18H,10H2,1-2H3.
What are the key properties of 2-(2-fluoro-3-methoxyphenyl)-1-(4-methylphenyl)ethanol?
2-(2-fluoro-3-methoxyphenyl)-1-(4-methylphenyl)ethanol has a molecular weight of 260.31 g/mol, XLogP of 3.42, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluoro-3-methoxyphenyl)-1-(4-methylphenyl)ethanol is sourced from PubChem (CID 104793076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).