1-[4-[(3-fluoro-4-methoxyphenyl)methoxy]phenyl]ethanol

C16H17FO3 — CID 43503631

IUPAC1-[4-[(3-fluoro-4-methoxyphenyl)methoxy]phenyl]ethanol
SMILESCOc1ccc(COc2ccc(C(C)O)cc2)cc1F
InChIInChI=1S/C16H17FO3/c1-11(18)13-4-6-14(7-5-13)20-10-12-3-8-16(19-2)15(17)9-12/h3-9,11,18H,10H2,1-2H3
InChIKeyAZPMACZSCXTZDK-UHFFFAOYSA-N
MW276.31 g/mol
LogP3.47
Rot. Bonds5

About 1-[4-[(3-fluoro-4-methoxyphenyl)methoxy]phenyl]ethanol

1-[4-[(3-fluoro-4-methoxyphenyl)methoxy]phenyl]ethanol (PubChem CID 43503631) has the molecular formula C16H17FO3 and a molecular weight of 276.31 g/mol. Its IUPAC name is 1-[4-[(3-fluoro-4-methoxyphenyl)methoxy]phenyl]ethanol.

Molecular Properties

Compound Name1-[4-[(3-fluoro-4-methoxyphenyl)methoxy]phenyl]ethanol
PubChem CID43503631
Molecular FormulaC16H17FO3
Molecular Weight276.31 g/mol
Exact Mass276.12
IUPAC Name1-[4-[(3-fluoro-4-methoxyphenyl)methoxy]phenyl]ethanol
SMILESCOc1ccc(COc2ccc(C(C)O)cc2)cc1F
InChIInChI=1S/C16H17FO3/c1-11(18)13-4-6-14(7-5-13)20-10-12-3-8-16(19-2)15(17)9-12/h3-9,11,18H,10H2,1-2H3
InChIKeyAZPMACZSCXTZDK-UHFFFAOYSA-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-[4-[(3,4-dimethoxyphenyl)methoxy]phenyl]ethanol
CID 78933373
(1R)-1-[2-fluoro-4-[(3-fluoro-4-methoxyphenyl)methoxy]phenyl]ethanol
CID 107720216
1-[3-fluoro-4-[(4-methoxyphenyl)methoxy]phenyl]ethanol
CID 115582214
4-[(3-fluoro-4-methoxyphenyl)methoxy]aniline
CID 43154828
2-fluoro-1-methoxy-4-(phenoxymethyl)benzene
CID 60627904
(1S)-1-[4-[(3-bromo-4-fluorophenyl)methoxy]phenyl]ethanol
CID 78930231
(1R)-1-[4-[(4-fluorophenyl)methoxy]phenyl]ethanol
CID 63364366
4-[(3-fluoro-4-methoxyphenyl)methoxy]benzamide
CID 7893423
2-(3-fluoro-4-methoxyphenyl)-1-(4-methoxyphenyl)ethanol
CID 62622685
1-[4-[(5-chloro-2-methoxyphenyl)methoxy]phenyl]ethanol
CID 43424347
[4-[(3-fluoro-4-methoxyphenyl)methoxy]phenyl]-phenylmethanone
CID 7717780
2-[4-[(3-fluoro-4-methoxyphenyl)methoxy]phenyl]ethanimidamide
CID 43332381

Frequently Asked Questions

What is the IUPAC name of 1-[4-[(3-fluoro-4-methoxyphenyl)methoxy]phenyl]ethanol?
The IUPAC name of 1-[4-[(3-fluoro-4-methoxyphenyl)methoxy]phenyl]ethanol (CID 43503631) is 1-[4-[(3-fluoro-4-methoxyphenyl)methoxy]phenyl]ethanol.
What is the SMILES notation for 1-[4-[(3-fluoro-4-methoxyphenyl)methoxy]phenyl]ethanol?
The canonical SMILES for 1-[4-[(3-fluoro-4-methoxyphenyl)methoxy]phenyl]ethanol is COc1ccc(COc2ccc(C(C)O)cc2)cc1F.
What is the InChIKey of 1-[4-[(3-fluoro-4-methoxyphenyl)methoxy]phenyl]ethanol?
The InChIKey is AZPMACZSCXTZDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17FO3/c1-11(18)13-4-6-14(7-5-13)20-10-12-3-8-16(19-2)15(17)9-12/h3-9,11,18H,10H2,1-2H3.
What are the key properties of 1-[4-[(3-fluoro-4-methoxyphenyl)methoxy]phenyl]ethanol?
1-[4-[(3-fluoro-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 1-[4-[(3-fluoro-4-methoxyphenyl)methoxy]phenyl]ethanol is sourced from PubChem (CID 43503631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).