(1R)-1-[4-[(4-fluoro-2-methylphenyl)methoxy]phenyl]ethanol

C16H17FO2 — CID 104894080

IUPAC(1R)-1-[4-[(4-fluoro-2-methylphenyl)methoxy]phenyl]ethanol
SMILESCc1cc(F)ccc1COc1ccc([C@@H](C)O)cc1
InChIInChI=1S/C16H17FO2/c1-11-9-15(17)6-3-14(11)10-19-16-7-4-13(5-8-16)12(2)18/h3-9,12,18H,10H2,1-2H3/t12-/m1/s1
InChIKeyOHYSKHLZUUBWGC-GFCCVEGCSA-N
MW260.31 g/mol
LogP3.77
Rot. Bonds4

About (1R)-1-[4-[(4-fluoro-2-methylphenyl)methoxy]phenyl]ethanol

(1R)-1-[4-[(4-fluoro-2-methylphenyl)methoxy]phenyl]ethanol (PubChem CID 104894080) has the molecular formula C16H17FO2 and a molecular weight of 260.31 g/mol. Its IUPAC name is (1R)-1-[4-[(4-fluoro-2-methylphenyl)methoxy]phenyl]ethanol.

Molecular Properties

Compound Name(1R)-1-[4-[(4-fluoro-2-methylphenyl)methoxy]phenyl]ethanol
PubChem CID104894080
Molecular FormulaC16H17FO2
Molecular Weight260.31 g/mol
Exact Mass260.12
IUPAC Name(1R)-1-[4-[(4-fluoro-2-methylphenyl)methoxy]phenyl]ethanol
SMILESCc1cc(F)ccc1COc1ccc([C@@H](C)O)cc1
InChIInChI=1S/C16H17FO2/c1-11-9-15(17)6-3-14(11)10-19-16-7-4-13(5-8-16)12(2)18/h3-9,12,18H,10H2,1-2H3/t12-/m1/s1
InChIKeyOHYSKHLZUUBWGC-GFCCVEGCSA-N
XLogP3.77
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 ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[4-[(2,4-difluorophenyl)methoxy]phenyl]ethanol
CID 62196202
(1R)-1-[4-[(4-fluoro-2-methylphenyl)methoxy]phenyl]ethanamine
CID 104894045
1-[4-[(4-fluoro-2-methylphenyl)methoxy]phenyl]ethanamine
CID 114345722
(1S)-1-[4-[(2,5-difluorophenyl)methoxy]phenyl]ethanol
CID 78930848
(1R)-1-[4-[(4-fluorophenyl)methoxy]phenyl]ethanol
CID 63364366
4-[(4-fluorophenoxy)methyl]-3-methylphenol
CID 117219687
(1R)-1-[4-[(4-chloro-2-fluorophenyl)methoxy]phenyl]ethanol
CID 104980144
1-(4-ethoxyphenyl)-2-(4-fluoro-2-methylphenyl)ethanol
CID 114346759
1-[4-[(2-chloro-4-methylphenyl)methoxy]phenyl]ethanol
CID 106864305
(1S)-1-[3-[(4-fluoro-2-methylphenyl)methoxy]phenyl]ethanamine
CID 104894054
(1R)-1-[4-[(2-bromo-4-fluorophenyl)methoxy]phenyl]propan-1-ol
CID 63365654
4-fluoro-3-[[4-[(1R)-1-hydroxyethyl]phenoxy]methyl]benzonitrile
CID 78930543

Frequently Asked Questions

What is the IUPAC name of (1R)-1-[4-[(4-fluoro-2-methylphenyl)methoxy]phenyl]ethanol?
The IUPAC name of (1R)-1-[4-[(4-fluoro-2-methylphenyl)methoxy]phenyl]ethanol (CID 104894080) is (1R)-1-[4-[(4-fluoro-2-methylphenyl)methoxy]phenyl]ethanol.
What is the SMILES notation for (1R)-1-[4-[(4-fluoro-2-methylphenyl)methoxy]phenyl]ethanol?
The canonical SMILES for (1R)-1-[4-[(4-fluoro-2-methylphenyl)methoxy]phenyl]ethanol is Cc1cc(F)ccc1COc1ccc([C@@H](C)O)cc1.
What is the InChIKey of (1R)-1-[4-[(4-fluoro-2-methylphenyl)methoxy]phenyl]ethanol?
The InChIKey is OHYSKHLZUUBWGC-GFCCVEGCSA-N. The full InChI is InChI=1S/C16H17FO2/c1-11-9-15(17)6-3-14(11)10-19-16-7-4-13(5-8-16)12(2)18/h3-9,12,18H,10H2,1-2H3/t12-/m1/s1.
What are the key properties of (1R)-1-[4-[(4-fluoro-2-methylphenyl)methoxy]phenyl]ethanol?
(1R)-1-[4-[(4-fluoro-2-methylphenyl)methoxy]phenyl]ethanol has a molecular weight of 260.31 g/mol, XLogP of 3.77, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[4-[(4-fluoro-2-methylphenyl)methoxy]phenyl]ethanol is sourced from PubChem (CID 104894080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).