(1R)-1-[4-[(5-fluoro-2-methylphenyl)methoxy]-3-methoxyphenyl]ethanol

C17H19FO3 — CID 105372092

IUPAC(1R)-1-[4-[(5-fluoro-2-methylphenyl)methoxy]-3-methoxyphenyl]ethanol
SMILESCOc1cc([C@@H](C)O)ccc1OCc1cc(F)ccc1C
InChIInChI=1S/C17H19FO3/c1-11-4-6-15(18)8-14(11)10-21-16-7-5-13(12(2)19)9-17(16)20-3/h4-9,12,19H,10H2,1-3H3/t12-/m1/s1
InChIKeyHDOUIYADNGJHLI-GFCCVEGCSA-N
MW290.33 g/mol
LogP3.78
Rot. Bonds5

About (1R)-1-[4-[(5-fluoro-2-methylphenyl)methoxy]-3-methoxyphenyl]ethanol

(1R)-1-[4-[(5-fluoro-2-methylphenyl)methoxy]-3-methoxyphenyl]ethanol (PubChem CID 105372092) has the molecular formula C17H19FO3 and a molecular weight of 290.33 g/mol. Its IUPAC name is (1R)-1-[4-[(5-fluoro-2-methylphenyl)methoxy]-3-methoxyphenyl]ethanol.

Molecular Properties

Compound Name(1R)-1-[4-[(5-fluoro-2-methylphenyl)methoxy]-3-methoxyphenyl]ethanol
PubChem CID105372092
Molecular FormulaC17H19FO3
Molecular Weight290.33 g/mol
Exact Mass290.13
IUPAC Name(1R)-1-[4-[(5-fluoro-2-methylphenyl)methoxy]-3-methoxyphenyl]ethanol
SMILESCOc1cc([C@@H](C)O)ccc1OCc1cc(F)ccc1C
InChIInChI=1S/C17H19FO3/c1-11-4-6-15(18)8-14(11)10-21-16-7-5-13(12(2)19)9-17(16)20-3/h4-9,12,19H,10H2,1-3H3/t12-/m1/s1
InChIKeyHDOUIYADNGJHLI-GFCCVEGCSA-N
XLogP3.78
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.33
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(1S)-1-[4-[(2-chloro-5-fluorophenyl)methoxy]-3-methoxyphenyl]ethanol
CID 102616497
(1R)-1-[4-[(3-fluorophenyl)methoxy]-3-methoxyphenyl]ethanol
CID 78931656
(1S)-1-[4-[(2,4-difluorophenyl)methoxy]-3-methoxyphenyl]ethanamine
CID 78930423
(1S)-1-(3-methoxy-4-phenylmethoxyphenyl)ethanol
CID 63364701
(1R)-1-[3-methoxy-4-(methoxymethoxy)phenyl]ethanol
CID 65364454
1-[4-[(4-fluorophenyl)methoxy]-3-methylphenyl]ethanol
CID 82090144
3-[(5-fluoro-2-methylphenyl)methoxy]-4-methoxyaniline
CID 105369714
1-[4-[(1R)-1-hydroxyethyl]-2-methoxyphenoxy]-2-methylpropan-2-ol
CID 63364683
(1R)-1-[4-[(4-chlorophenyl)methoxy]-3-methoxyphenyl]ethanol
CID 78931221
1-[5-fluoro-2-[(2-fluoro-3-methoxyphenyl)methoxy]phenyl]ethanol
CID 104792501
1-[3-methoxy-4-(1,2-oxazol-5-ylmethoxy)phenyl]ethanol
CID 43503809
1-[3-methoxy-4-[(5-methyl-3-pyridinyl)methoxy]phenyl]ethanol
CID 102881584

Frequently Asked Questions

What is the IUPAC name of (1R)-1-[4-[(5-fluoro-2-methylphenyl)methoxy]-3-methoxyphenyl]ethanol?
The IUPAC name of (1R)-1-[4-[(5-fluoro-2-methylphenyl)methoxy]-3-methoxyphenyl]ethanol (CID 105372092) is (1R)-1-[4-[(5-fluoro-2-methylphenyl)methoxy]-3-methoxyphenyl]ethanol.
What is the SMILES notation for (1R)-1-[4-[(5-fluoro-2-methylphenyl)methoxy]-3-methoxyphenyl]ethanol?
The canonical SMILES for (1R)-1-[4-[(5-fluoro-2-methylphenyl)methoxy]-3-methoxyphenyl]ethanol is COc1cc([C@@H](C)O)ccc1OCc1cc(F)ccc1C.
What is the InChIKey of (1R)-1-[4-[(5-fluoro-2-methylphenyl)methoxy]-3-methoxyphenyl]ethanol?
The InChIKey is HDOUIYADNGJHLI-GFCCVEGCSA-N. The full InChI is InChI=1S/C17H19FO3/c1-11-4-6-15(18)8-14(11)10-21-16-7-5-13(12(2)19)9-17(16)20-3/h4-9,12,19H,10H2,1-3H3/t12-/m1/s1.
What are the key properties of (1R)-1-[4-[(5-fluoro-2-methylphenyl)methoxy]-3-methoxyphenyl]ethanol?
(1R)-1-[4-[(5-fluoro-2-methylphenyl)methoxy]-3-methoxyphenyl]ethanol has a molecular weight of 290.33 g/mol, XLogP of 3.78, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[4-[(5-fluoro-2-methylphenyl)methoxy]-3-methoxyphenyl]ethanol is sourced from PubChem (CID 105372092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).