(1S)-1-[2-[(2-fluorophenyl)methoxy]-5-methylphenyl]ethanol

C16H17FO2 — CID 78934333

IUPAC(1S)-1-[2-[(2-fluorophenyl)methoxy]-5-methylphenyl]ethanol
SMILESCc1ccc(OCc2ccccc2F)c([C@H](C)O)c1
InChIInChI=1S/C16H17FO2/c1-11-7-8-16(14(9-11)12(2)18)19-10-13-5-3-4-6-15(13)17/h3-9,12,18H,10H2,1-2H3/t12-/m0/s1
InChIKeyYWFKPEVDDIWZEJ-LBPRGKRZSA-N
MW260.31 g/mol
LogP3.77
Rot. Bonds4

About (1S)-1-[2-[(2-fluorophenyl)methoxy]-5-methylphenyl]ethanol

(1S)-1-[2-[(2-fluorophenyl)methoxy]-5-methylphenyl]ethanol (PubChem CID 78934333) has the molecular formula C16H17FO2 and a molecular weight of 260.31 g/mol. Its IUPAC name is (1S)-1-[2-[(2-fluorophenyl)methoxy]-5-methylphenyl]ethanol.

Molecular Properties

Compound Name(1S)-1-[2-[(2-fluorophenyl)methoxy]-5-methylphenyl]ethanol
PubChem CID78934333
Molecular FormulaC16H17FO2
Molecular Weight260.31 g/mol
Exact Mass260.12
IUPAC Name(1S)-1-[2-[(2-fluorophenyl)methoxy]-5-methylphenyl]ethanol
SMILESCc1ccc(OCc2ccccc2F)c([C@H](C)O)c1
InChIInChI=1S/C16H17FO2/c1-11-7-8-16(14(9-11)12(2)18)19-10-13-5-3-4-6-15(13)17/h3-9,12,18H,10H2,1-2H3/t12-/m0/s1
InChIKeyYWFKPEVDDIWZEJ-LBPRGKRZSA-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

(1S)-1-[2-[(2,6-difluorophenyl)methoxy]-5-methylphenyl]ethanol
CID 104984970
(1R)-1-[2-[(2-methoxyphenyl)methoxy]-5-methylphenyl]ethanol
CID 63366482
(1S)-1-[2-[(2-fluoro-4-methoxyphenyl)methoxy]-5-methylphenyl]ethanol
CID 102877108
N-ethyl-1-[2-[(2-fluorophenyl)methoxy]-5-methylphenyl]ethanamine
CID 43505172
(1S)-1-[2-[(3-chloro-2-fluorophenyl)methoxy]-5-methylphenyl]ethanol
CID 102856296
1-[2-[(2,5-dimethylphenyl)methoxy]-5-methylphenyl]ethanol
CID 61481674
(1R)-1-[2-[(2,3-dichlorophenyl)methoxy]-5-methylphenyl]ethanol
CID 107306824
1-[2-[(2-fluorophenyl)methoxy]-5-methylphenyl]propan-2-amine
CID 63326290
1-[2-[(2-chloro-4-methylphenyl)methoxy]-5-methylphenyl]ethanol
CID 106864318
(1S)-1-[2-[(3,5-difluorophenyl)methoxy]-5-methylphenyl]ethanol
CID 105404171
1-[4-bromo-2-[(2-fluorophenyl)methoxy]phenyl]ethanol
CID 102948307
2-[(2-fluorophenyl)methoxy]-5-methylaniline
CID 39247930

Frequently Asked Questions

What is the IUPAC name of (1S)-1-[2-[(2-fluorophenyl)methoxy]-5-methylphenyl]ethanol?
The IUPAC name of (1S)-1-[2-[(2-fluorophenyl)methoxy]-5-methylphenyl]ethanol (CID 78934333) is (1S)-1-[2-[(2-fluorophenyl)methoxy]-5-methylphenyl]ethanol.
What is the SMILES notation for (1S)-1-[2-[(2-fluorophenyl)methoxy]-5-methylphenyl]ethanol?
The canonical SMILES for (1S)-1-[2-[(2-fluorophenyl)methoxy]-5-methylphenyl]ethanol is Cc1ccc(OCc2ccccc2F)c([C@H](C)O)c1.
What is the InChIKey of (1S)-1-[2-[(2-fluorophenyl)methoxy]-5-methylphenyl]ethanol?
The InChIKey is YWFKPEVDDIWZEJ-LBPRGKRZSA-N. The full InChI is InChI=1S/C16H17FO2/c1-11-7-8-16(14(9-11)12(2)18)19-10-13-5-3-4-6-15(13)17/h3-9,12,18H,10H2,1-2H3/t12-/m0/s1.
What are the key properties of (1S)-1-[2-[(2-fluorophenyl)methoxy]-5-methylphenyl]ethanol?
(1S)-1-[2-[(2-fluorophenyl)methoxy]-5-methylphenyl]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 (1S)-1-[2-[(2-fluorophenyl)methoxy]-5-methylphenyl]ethanol is sourced from PubChem (CID 78934333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).