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

C16H17FO3 — CID 107720145

IUPAC(1R)-1-[2-fluoro-4-[(4-methoxyphenyl)methoxy]phenyl]ethanol
SMILESCOc1ccc(COc2ccc([C@@H](C)O)c(F)c2)cc1
InChIInChI=1S/C16H17FO3/c1-11(18)15-8-7-14(9-16(15)17)20-10-12-3-5-13(19-2)6-4-12/h3-9,11,18H,10H2,1-2H3/t11-/m1/s1
InChIKeyNWUZQPLVVQIYPR-LLVKDONJSA-N
MW276.31 g/mol
LogP3.47
Rot. Bonds5

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

(1R)-1-[2-fluoro-4-[(4-methoxyphenyl)methoxy]phenyl]ethanol (PubChem CID 107720145) has the molecular formula C16H17FO3 and a molecular weight of 276.31 g/mol. Its IUPAC name is (1R)-1-[2-fluoro-4-[(4-methoxyphenyl)methoxy]phenyl]ethanol.

Molecular Properties

Compound Name(1R)-1-[2-fluoro-4-[(4-methoxyphenyl)methoxy]phenyl]ethanol
PubChem CID107720145
Molecular FormulaC16H17FO3
Molecular Weight276.31 g/mol
Exact Mass276.12
IUPAC Name(1R)-1-[2-fluoro-4-[(4-methoxyphenyl)methoxy]phenyl]ethanol
SMILESCOc1ccc(COc2ccc([C@@H](C)O)c(F)c2)cc1
InChIInChI=1S/C16H17FO3/c1-11(18)15-8-7-14(9-16(15)17)20-10-12-3-5-13(19-2)6-4-12/h3-9,11,18H,10H2,1-2H3/t11-/m1/s1
InChIKeyNWUZQPLVVQIYPR-LLVKDONJSA-N
XLogP3.47
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.31
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(1S)-1-[2-fluoro-4-[(4-iodophenyl)methoxy]phenyl]ethanol
CID 107720343
(1R)-1-[2-fluoro-4-[(3-fluoro-4-methoxyphenyl)methoxy]phenyl]ethanol
CID 107720216
(1S)-1-[2-fluoro-4-[2-(4-methoxyphenyl)ethoxy]phenyl]ethanol
CID 107720305
(1R)-1-[4-[(3,4-difluorophenyl)methoxy]-2-fluorophenyl]ethanol
CID 107719922
4-[[3-fluoro-4-[(1R)-1-hydroxyethyl]phenoxy]methyl]benzoic acid
CID 107719952
(1R)-1-[2-fluoro-4-(methoxymethoxy)phenyl]ethanol
CID 107720039
(1S)-1-[2-fluoro-4-(pyridin-3-ylmethoxy)phenyl]ethanol
CID 107720608
(1R)-1-[2-fluoro-4-(pyrimidin-2-ylmethoxy)phenyl]ethanol
CID 107720035
(1R)-1-[2-fluoro-4-(phenylmethoxymethoxy)phenyl]ethanol
CID 107720224
1-(2-fluoro-4-propoxyphenyl)ethanol
CID 107719521
(1R)-1-[2-fluoro-4-[(4-fluorophenyl)methoxy]phenyl]ethanamine
CID 107718259
1-[3-fluoro-4-[(4-methoxyphenyl)methoxy]phenyl]ethanol
CID 115582214

Frequently Asked Questions

What is the IUPAC name of (1R)-1-[2-fluoro-4-[(4-methoxyphenyl)methoxy]phenyl]ethanol?
The IUPAC name of (1R)-1-[2-fluoro-4-[(4-methoxyphenyl)methoxy]phenyl]ethanol (CID 107720145) is (1R)-1-[2-fluoro-4-[(4-methoxyphenyl)methoxy]phenyl]ethanol.
What is the SMILES notation for (1R)-1-[2-fluoro-4-[(4-methoxyphenyl)methoxy]phenyl]ethanol?
The canonical SMILES for (1R)-1-[2-fluoro-4-[(4-methoxyphenyl)methoxy]phenyl]ethanol is COc1ccc(COc2ccc([C@@H](C)O)c(F)c2)cc1.
What is the InChIKey of (1R)-1-[2-fluoro-4-[(4-methoxyphenyl)methoxy]phenyl]ethanol?
The InChIKey is NWUZQPLVVQIYPR-LLVKDONJSA-N. The full InChI is InChI=1S/C16H17FO3/c1-11(18)15-8-7-14(9-16(15)17)20-10-12-3-5-13(19-2)6-4-12/h3-9,11,18H,10H2,1-2H3/t11-/m1/s1.
What are the key properties of (1R)-1-[2-fluoro-4-[(4-methoxyphenyl)methoxy]phenyl]ethanol?
(1R)-1-[2-fluoro-4-[(4-methoxyphenyl)methoxy]phenyl]ethanol has a molecular weight of 276.31 g/mol, XLogP of 3.47, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[2-fluoro-4-[(4-methoxyphenyl)methoxy]phenyl]ethanol is sourced from PubChem (CID 107720145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).