1-[2-(2-fluoro-3-methylphenoxy)-6-methoxyphenyl]ethanol

C16H17FO3 — CID 107659175

IUPAC1-[2-(2-fluoro-3-methylphenoxy)-6-methoxyphenyl]ethanol
SMILESCOc1cccc(Oc2cccc(C)c2F)c1C(C)O
InChIInChI=1S/C16H17FO3/c1-10-6-4-9-14(16(10)17)20-13-8-5-7-12(19-3)15(13)11(2)18/h4-9,11,18H,1-3H3
InChIKeyOGPNRXHRQJMZAX-UHFFFAOYSA-N
MW276.31 g/mol
LogP3.99
Rot. Bonds4

About 1-[2-(2-fluoro-3-methylphenoxy)-6-methoxyphenyl]ethanol

1-[2-(2-fluoro-3-methylphenoxy)-6-methoxyphenyl]ethanol (PubChem CID 107659175) has the molecular formula C16H17FO3 and a molecular weight of 276.31 g/mol. Its IUPAC name is 1-[2-(2-fluoro-3-methylphenoxy)-6-methoxyphenyl]ethanol.

Molecular Properties

Compound Name1-[2-(2-fluoro-3-methylphenoxy)-6-methoxyphenyl]ethanol
PubChem CID107659175
Molecular FormulaC16H17FO3
Molecular Weight276.31 g/mol
Exact Mass276.12
IUPAC Name1-[2-(2-fluoro-3-methylphenoxy)-6-methoxyphenyl]ethanol
SMILESCOc1cccc(Oc2cccc(C)c2F)c1C(C)O
InChIInChI=1S/C16H17FO3/c1-10-6-4-9-14(16(10)17)20-13-8-5-7-12(19-3)15(13)11(2)18/h4-9,11,18H,1-3H3
InChIKeyOGPNRXHRQJMZAX-UHFFFAOYSA-N
XLogP3.99
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.31
LogP ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2,6-dimethoxyphenyl)-(2-fluoro-3-methylphenyl)methanol
CID 115838581
1-[2-fluoro-6-(2-methylphenoxy)phenyl]ethanol
CID 43506466
1-(2-methoxy-6-phenoxyphenyl)ethanol
CID 113389264
(1R)-1-[3-fluoro-4-(2-fluoro-3-methylphenoxy)phenyl]ethanol
CID 107659139
(1R)-1-[2-fluoro-6-(2-fluoro-3-methylphenoxy)phenyl]ethanamine
CID 107658794
1-[2-fluoro-6-(2-methoxy-4-methylphenoxy)phenyl]ethanol
CID 43506269
(1S)-1-[2-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-6-methoxyphenyl]ethanol
CID 103175163
1-[2-(2-bromo-4-methoxyphenoxy)-6-methoxyphenyl]ethanol
CID 104707975
1-(2,3-difluoro-6-methoxyphenyl)ethanol
CID 58022414
(2,6-dimethoxyphenyl)-(2-fluoro-3-methylphenyl)methanamine
CID 105051988
(1R)-1-[2-(2-fluoro-3-methylphenoxy)-4-pyridinyl]ethanol
CID 107659141
(1R)-1-[2-(2,5-dimethylphenoxy)-6-fluorophenyl]ethanol
CID 78941581

Frequently Asked Questions

What is the IUPAC name of 1-[2-(2-fluoro-3-methylphenoxy)-6-methoxyphenyl]ethanol?
The IUPAC name of 1-[2-(2-fluoro-3-methylphenoxy)-6-methoxyphenyl]ethanol (CID 107659175) is 1-[2-(2-fluoro-3-methylphenoxy)-6-methoxyphenyl]ethanol.
What is the SMILES notation for 1-[2-(2-fluoro-3-methylphenoxy)-6-methoxyphenyl]ethanol?
The canonical SMILES for 1-[2-(2-fluoro-3-methylphenoxy)-6-methoxyphenyl]ethanol is COc1cccc(Oc2cccc(C)c2F)c1C(C)O.
What is the InChIKey of 1-[2-(2-fluoro-3-methylphenoxy)-6-methoxyphenyl]ethanol?
The InChIKey is OGPNRXHRQJMZAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17FO3/c1-10-6-4-9-14(16(10)17)20-13-8-5-7-12(19-3)15(13)11(2)18/h4-9,11,18H,1-3H3.
What are the key properties of 1-[2-(2-fluoro-3-methylphenoxy)-6-methoxyphenyl]ethanol?
1-[2-(2-fluoro-3-methylphenoxy)-6-methoxyphenyl]ethanol has a molecular weight of 276.31 g/mol, XLogP of 3.99, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2-fluoro-3-methylphenoxy)-6-methoxyphenyl]ethanol is sourced from PubChem (CID 107659175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).