[4-(2,3-difluorophenoxy)quinolin-2-yl]methanol

C16H11F2NO2 — CID 63375849

IUPAC[4-(2,3-difluorophenoxy)quinolin-2-yl]methanol
SMILESOCc1cc(Oc2cccc(F)c2F)c2ccccc2n1
InChIInChI=1S/C16H11F2NO2/c17-12-5-3-7-14(16(12)18)21-15-8-10(9-20)19-13-6-2-1-4-11(13)15/h1-8,20H,9H2
InChIKeyDFSIBPYXTUVAKJ-UHFFFAOYSA-N
MW287.27 g/mol
LogP3.80
Rot. Bonds3

About [4-(2,3-difluorophenoxy)quinolin-2-yl]methanol

[4-(2,3-difluorophenoxy)quinolin-2-yl]methanol (PubChem CID 63375849) has the molecular formula C16H11F2NO2 and a molecular weight of 287.27 g/mol. Its IUPAC name is [4-(2,3-difluorophenoxy)quinolin-2-yl]methanol.

Molecular Properties

Compound Name[4-(2,3-difluorophenoxy)quinolin-2-yl]methanol
PubChem CID63375849
Molecular FormulaC16H11F2NO2
Molecular Weight287.27 g/mol
Exact Mass287.08
IUPAC Name[4-(2,3-difluorophenoxy)quinolin-2-yl]methanol
SMILESOCc1cc(Oc2cccc(F)c2F)c2ccccc2n1
InChIInChI=1S/C16H11F2NO2/c17-12-5-3-7-14(16(12)18)21-15-8-10(9-20)19-13-6-2-1-4-11(13)15/h1-8,20H,9H2
InChIKeyDFSIBPYXTUVAKJ-UHFFFAOYSA-N
XLogP3.80
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.27
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[4-(2-fluoro-3-methylphenoxy)quinolin-2-yl]methanol
CID 107660035
[4-(2-chlorophenoxy)quinolin-2-yl]methanol
CID 63375932
[2-(2,3-difluorophenoxy)quinolin-3-yl]methanol
CID 63036604
[4-(3-methylphenoxy)quinolin-2-yl]methanol
CID 63376019
[4-(2-methoxyethoxy)quinolin-2-yl]methanol
CID 63376021
[4-(2-methylbutan-2-yloxy)quinolin-2-yl]methanol
CID 63376065
[4-[(3-chlorophenyl)methoxy]quinolin-2-yl]methanol
CID 65126437
4-(2-bromo-4-fluorophenoxy)-2-(chloromethyl)quinoline
CID 63445972
[4-(oxetan-3-yloxy)quinolin-2-yl]methanol
CID 102607123
[4-(2,3-dimethylphenoxy)quinolin-2-yl]methanamine
CID 63377413
[4-(2,3-difluorophenoxy)quinolin-3-yl]methanamine
CID 63037258
[4-(furan-2-ylmethoxy)quinolin-2-yl]methanol
CID 55184161

Frequently Asked Questions

What is the IUPAC name of [4-(2,3-difluorophenoxy)quinolin-2-yl]methanol?
The IUPAC name of [4-(2,3-difluorophenoxy)quinolin-2-yl]methanol (CID 63375849) is [4-(2,3-difluorophenoxy)quinolin-2-yl]methanol.
What is the SMILES notation for [4-(2,3-difluorophenoxy)quinolin-2-yl]methanol?
The canonical SMILES for [4-(2,3-difluorophenoxy)quinolin-2-yl]methanol is OCc1cc(Oc2cccc(F)c2F)c2ccccc2n1.
What is the InChIKey of [4-(2,3-difluorophenoxy)quinolin-2-yl]methanol?
The InChIKey is DFSIBPYXTUVAKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11F2NO2/c17-12-5-3-7-14(16(12)18)21-15-8-10(9-20)19-13-6-2-1-4-11(13)15/h1-8,20H,9H2.
What are the key properties of [4-(2,3-difluorophenoxy)quinolin-2-yl]methanol?
[4-(2,3-difluorophenoxy)quinolin-2-yl]methanol has a molecular weight of 287.27 g/mol, XLogP of 3.80, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2,3-difluorophenoxy)quinolin-2-yl]methanol is sourced from PubChem (CID 63375849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).