[2-(3-fluoro-4-methylphenoxy)quinolin-3-yl]methanol

C17H14FNO2 — CID 107169696

IUPAC[2-(3-fluoro-4-methylphenoxy)quinolin-3-yl]methanol
SMILESCc1ccc(Oc2nc3ccccc3cc2CO)cc1F
InChIInChI=1S/C17H14FNO2/c1-11-6-7-14(9-15(11)18)21-17-13(10-20)8-12-4-2-3-5-16(12)19-17/h2-9,20H,10H2,1H3
InChIKeyIULUYRCMOAQKJG-UHFFFAOYSA-N
MW283.30 g/mol
LogP3.97
Rot. Bonds3

About [2-(3-fluoro-4-methylphenoxy)quinolin-3-yl]methanol

[2-(3-fluoro-4-methylphenoxy)quinolin-3-yl]methanol (PubChem CID 107169696) has the molecular formula C17H14FNO2 and a molecular weight of 283.30 g/mol. Its IUPAC name is [2-(3-fluoro-4-methylphenoxy)quinolin-3-yl]methanol.

Molecular Properties

Compound Name[2-(3-fluoro-4-methylphenoxy)quinolin-3-yl]methanol
PubChem CID107169696
Molecular FormulaC17H14FNO2
Molecular Weight283.30 g/mol
Exact Mass283.10
IUPAC Name[2-(3-fluoro-4-methylphenoxy)quinolin-3-yl]methanol
SMILESCc1ccc(Oc2nc3ccccc3cc2CO)cc1F
InChIInChI=1S/C17H14FNO2/c1-11-6-7-14(9-15(11)18)21-17-13(10-20)8-12-4-2-3-5-16(12)19-17/h2-9,20H,10H2,1H3
InChIKeyIULUYRCMOAQKJG-UHFFFAOYSA-N
XLogP3.97
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.30
LogP ≤ 53.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[4-[3-(hydroxymethyl)quinolin-2-yl]oxyphenyl]methanol
CID 61229145
[1-(3-fluoro-4-methylphenoxy)isoquinolin-3-yl]methanol
CID 107170110
[2-(2,3-difluorophenoxy)quinolin-3-yl]methanol
CID 63036604
[2-[3-(hydroxymethyl)quinolin-2-yl]oxyphenyl]methanol
CID 63653966
2-(4-chloro-3-fluorophenoxy)-3-(chloromethyl)quinoline
CID 82718093
[2-(2,5-dichlorophenoxy)quinolin-3-yl]methanol
CID 28964083
3-(bromomethyl)-2-(4-bromo-3-methylphenoxy)quinoline
CID 107089091
4-(3-fluoro-4-methylphenoxy)-N-methylquinazolin-2-amine
CID 107171754
[2-(4-fluorophenoxy)quinolin-3-yl]methanamine
CID 28966185
1-[2-(4-fluorophenoxy)quinolin-3-yl]-N-methylmethanamine
CID 43283154
[2-(3-fluoro-4-methylphenoxy)imidazo[1,2-a]pyridin-3-yl]methanamine
CID 107169942
[5-chloro-6-(3-fluoro-4-methylphenoxy)-3-pyridinyl]methanol
CID 107170106

Frequently Asked Questions

What is the IUPAC name of [2-(3-fluoro-4-methylphenoxy)quinolin-3-yl]methanol?
The IUPAC name of [2-(3-fluoro-4-methylphenoxy)quinolin-3-yl]methanol (CID 107169696) is [2-(3-fluoro-4-methylphenoxy)quinolin-3-yl]methanol.
What is the SMILES notation for [2-(3-fluoro-4-methylphenoxy)quinolin-3-yl]methanol?
The canonical SMILES for [2-(3-fluoro-4-methylphenoxy)quinolin-3-yl]methanol is Cc1ccc(Oc2nc3ccccc3cc2CO)cc1F.
What is the InChIKey of [2-(3-fluoro-4-methylphenoxy)quinolin-3-yl]methanol?
The InChIKey is IULUYRCMOAQKJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14FNO2/c1-11-6-7-14(9-15(11)18)21-17-13(10-20)8-12-4-2-3-5-16(12)19-17/h2-9,20H,10H2,1H3.
What are the key properties of [2-(3-fluoro-4-methylphenoxy)quinolin-3-yl]methanol?
[2-(3-fluoro-4-methylphenoxy)quinolin-3-yl]methanol has a molecular weight of 283.30 g/mol, XLogP of 3.97, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(3-fluoro-4-methylphenoxy)quinolin-3-yl]methanol is sourced from PubChem (CID 107169696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).