[5-fluoro-2-(1-methoxypropan-2-yloxy)phenyl]methanol

C11H15FO3 — CID 107698403

IUPAC[5-fluoro-2-(1-methoxypropan-2-yloxy)phenyl]methanol
SMILESCOCC(C)Oc1ccc(F)cc1CO
InChIInChI=1S/C11H15FO3/c1-8(7-14-2)15-11-4-3-10(12)5-9(11)6-13/h3-5,8,13H,6-7H2,1-2H3
InChIKeyDYMUHVDVHURFPU-UHFFFAOYSA-N
MW214.24 g/mol
LogP1.73
Rot. Bonds5

About [5-fluoro-2-(1-methoxypropan-2-yloxy)phenyl]methanol

[5-fluoro-2-(1-methoxypropan-2-yloxy)phenyl]methanol (PubChem CID 107698403) has the molecular formula C11H15FO3 and a molecular weight of 214.24 g/mol. Its IUPAC name is [5-fluoro-2-(1-methoxypropan-2-yloxy)phenyl]methanol.

Molecular Properties

Compound Name[5-fluoro-2-(1-methoxypropan-2-yloxy)phenyl]methanol
PubChem CID107698403
Molecular FormulaC11H15FO3
Molecular Weight214.24 g/mol
Exact Mass214.10
IUPAC Name[5-fluoro-2-(1-methoxypropan-2-yloxy)phenyl]methanol
SMILESCOCC(C)Oc1ccc(F)cc1CO
InChIInChI=1S/C11H15FO3/c1-8(7-14-2)15-11-4-3-10(12)5-9(11)6-13/h3-5,8,13H,6-7H2,1-2H3
InChIKeyDYMUHVDVHURFPU-UHFFFAOYSA-N
XLogP1.73
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.24
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[4-fluoro-2-(hydroxymethyl)phenoxy]butan-2-ol
CID 107698582
(1R)-1-[5-fluoro-2-(1-methoxypropan-2-yloxy)phenyl]ethanamine
CID 78956396
1-[4-fluoro-2-(hydroxymethyl)phenoxy]butan-2-ol
CID 107698659
N-[[5-fluoro-2-(4-methoxybutan-2-yloxy)phenyl]methyl]propan-2-amine
CID 107696080
[5-fluoro-2-[2-methoxyethyl(1-methoxypropan-2-yl)amino]phenyl]methanol
CID 55005532
2-[4-fluoro-2-(hydroxymethyl)phenoxy]-N-propylpropanamide
CID 107698502
[5-fluoro-2-(2-methylsulfanylethoxy)phenyl]methanol
CID 107698407
(5-fluoro-2-hexoxyphenyl)methanol
CID 91657337
[2-[2-(dimethylamino)ethoxy]-5-fluorophenyl]methanol
CID 107698691
[5-chloro-3-methoxy-2-(1-methoxypropan-2-yloxy)phenyl]methanol
CID 113438824
3-[4-fluoro-2-(hydroxymethyl)phenoxy]-N-propan-2-ylpropanamide
CID 107698389
1-[(2R)-1-methoxypropan-2-yl]oxy-2,4-dimethylbenzene
CID 70331927

Frequently Asked Questions

What is the IUPAC name of [5-fluoro-2-(1-methoxypropan-2-yloxy)phenyl]methanol?
The IUPAC name of [5-fluoro-2-(1-methoxypropan-2-yloxy)phenyl]methanol (CID 107698403) is [5-fluoro-2-(1-methoxypropan-2-yloxy)phenyl]methanol.
What is the SMILES notation for [5-fluoro-2-(1-methoxypropan-2-yloxy)phenyl]methanol?
The canonical SMILES for [5-fluoro-2-(1-methoxypropan-2-yloxy)phenyl]methanol is COCC(C)Oc1ccc(F)cc1CO.
What is the InChIKey of [5-fluoro-2-(1-methoxypropan-2-yloxy)phenyl]methanol?
The InChIKey is DYMUHVDVHURFPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15FO3/c1-8(7-14-2)15-11-4-3-10(12)5-9(11)6-13/h3-5,8,13H,6-7H2,1-2H3.
What are the key properties of [5-fluoro-2-(1-methoxypropan-2-yloxy)phenyl]methanol?
[5-fluoro-2-(1-methoxypropan-2-yloxy)phenyl]methanol has a molecular weight of 214.24 g/mol, XLogP of 1.73, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [5-fluoro-2-(1-methoxypropan-2-yloxy)phenyl]methanol is sourced from PubChem (CID 107698403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).