(2-fluoro-4-methoxyphenyl)-(2,4,5-trimethyloxolan-3-yl)methanol

C15H21FO3 — CID 65158185

IUPAC(2-fluoro-4-methoxyphenyl)-(2,4,5-trimethyloxolan-3-yl)methanol
SMILESCOc1ccc(C(O)C2C(C)OC(C)C2C)c(F)c1
InChIInChI=1S/C15H21FO3/c1-8-9(2)19-10(3)14(8)15(17)12-6-5-11(18-4)7-13(12)16/h5-10,14-15,17H,1-4H3
InChIKeyOMAMMKRZMNCOGG-UHFFFAOYSA-N
MW268.33 g/mol
LogP2.93
Rot. Bonds3

About (2-fluoro-4-methoxyphenyl)-(2,4,5-trimethyloxolan-3-yl)methanol

(2-fluoro-4-methoxyphenyl)-(2,4,5-trimethyloxolan-3-yl)methanol (PubChem CID 65158185) has the molecular formula C15H21FO3 and a molecular weight of 268.33 g/mol. Its IUPAC name is (2-fluoro-4-methoxyphenyl)-(2,4,5-trimethyloxolan-3-yl)methanol.

Molecular Properties

Compound Name(2-fluoro-4-methoxyphenyl)-(2,4,5-trimethyloxolan-3-yl)methanol
PubChem CID65158185
Molecular FormulaC15H21FO3
Molecular Weight268.33 g/mol
Exact Mass268.15
IUPAC Name(2-fluoro-4-methoxyphenyl)-(2,4,5-trimethyloxolan-3-yl)methanol
SMILESCOc1ccc(C(O)C2C(C)OC(C)C2C)c(F)c1
InChIInChI=1S/C15H21FO3/c1-8-9(2)19-10(3)14(8)15(17)12-6-5-11(18-4)7-13(12)16/h5-10,14-15,17H,1-4H3
InChIKeyOMAMMKRZMNCOGG-UHFFFAOYSA-N
XLogP2.93
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.33
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(4-chloro-2-fluorophenyl)-(2,4,5-trimethyloxolan-3-yl)methanol
CID 115827775
bis(2-fluoro-4-methoxyphenyl)methanol
CID 102884350
(1R,2S)-2-amino-1-cyclopropyl-2-(2-fluoro-4-methoxyphenyl)ethanol
CID 171161417
(4-bromo-3-chloro-2-fluorophenyl)-(2,4,5-trimethyloxolan-3-yl)methanol
CID 106765094
(1R)-2,2-difluoro-1-(2-fluoro-4-methoxyphenyl)ethanamine
CID 130665860
2-(2-fluoro-4-methoxyphenyl)-2-hydroxyacetaldehyde
CID 103395038
1-(2-fluoro-4-methoxyphenyl)propane-1,2,3-triol
CID 170817736
(1S,2R)-2-amino-1-cyclobutyl-2-(2-fluoro-4-methoxyphenyl)ethanol
CID 171159980
2,2,3,3,3-pentafluoro-1-(2-fluoro-4-methoxyphenyl)propan-1-ol
CID 61081494
(3,5-difluorophenyl)-(2-fluoro-4-methoxyphenyl)methanol
CID 61083265
(3-bromo-4-methoxyphenyl)-(2,4,5-trimethyloxolan-3-yl)methanol
CID 65160656
(4-ethylcyclohexyl)-(2-fluoro-4-methoxyphenyl)methanol
CID 81304806

Frequently Asked Questions

What is the IUPAC name of (2-fluoro-4-methoxyphenyl)-(2,4,5-trimethyloxolan-3-yl)methanol?
The IUPAC name of (2-fluoro-4-methoxyphenyl)-(2,4,5-trimethyloxolan-3-yl)methanol (CID 65158185) is (2-fluoro-4-methoxyphenyl)-(2,4,5-trimethyloxolan-3-yl)methanol.
What is the SMILES notation for (2-fluoro-4-methoxyphenyl)-(2,4,5-trimethyloxolan-3-yl)methanol?
The canonical SMILES for (2-fluoro-4-methoxyphenyl)-(2,4,5-trimethyloxolan-3-yl)methanol is COc1ccc(C(O)C2C(C)OC(C)C2C)c(F)c1.
What is the InChIKey of (2-fluoro-4-methoxyphenyl)-(2,4,5-trimethyloxolan-3-yl)methanol?
The InChIKey is OMAMMKRZMNCOGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21FO3/c1-8-9(2)19-10(3)14(8)15(17)12-6-5-11(18-4)7-13(12)16/h5-10,14-15,17H,1-4H3.
What are the key properties of (2-fluoro-4-methoxyphenyl)-(2,4,5-trimethyloxolan-3-yl)methanol?
(2-fluoro-4-methoxyphenyl)-(2,4,5-trimethyloxolan-3-yl)methanol has a molecular weight of 268.33 g/mol, XLogP of 2.93, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-fluoro-4-methoxyphenyl)-(2,4,5-trimethyloxolan-3-yl)methanol is sourced from PubChem (CID 65158185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).