[2-(4-fluorophenoxy)quinolin-3-yl]methanamine

C16H13FN2O — CID 28966185

IUPAC[2-(4-fluorophenoxy)quinolin-3-yl]methanamine
SMILESNCc1cc2ccccc2nc1Oc1ccc(F)cc1
InChIInChI=1S/C16H13FN2O/c17-13-5-7-14(8-6-13)20-16-12(10-18)9-11-3-1-2-4-15(11)19-16/h1-9H,10,18H2
InChIKeyYOXCAZXKLXPCHE-UHFFFAOYSA-N
MW268.29 g/mol
LogP3.62
Rot. Bonds3

About [2-(4-fluorophenoxy)quinolin-3-yl]methanamine

[2-(4-fluorophenoxy)quinolin-3-yl]methanamine (PubChem CID 28966185) has the molecular formula C16H13FN2O and a molecular weight of 268.29 g/mol. Its IUPAC name is [2-(4-fluorophenoxy)quinolin-3-yl]methanamine.

Molecular Properties

Compound Name[2-(4-fluorophenoxy)quinolin-3-yl]methanamine
PubChem CID28966185
Molecular FormulaC16H13FN2O
Molecular Weight268.29 g/mol
Exact Mass268.10
IUPAC Name[2-(4-fluorophenoxy)quinolin-3-yl]methanamine
SMILESNCc1cc2ccccc2nc1Oc1ccc(F)cc1
InChIInChI=1S/C16H13FN2O/c17-13-5-7-14(8-6-13)20-16-12(10-18)9-11-3-1-2-4-15(11)19-16/h1-9H,10,18H2
InChIKeyYOXCAZXKLXPCHE-UHFFFAOYSA-N
XLogP3.62
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.29
LogP ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [2-(4-fluorophenoxy)quinolin-3-yl]methanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[2-(4-methylsulfanylphenoxy)quinolin-3-yl]methanamine
CID 63648716
1-[2-(4-fluorophenoxy)quinolin-3-yl]-N-methylmethanamine
CID 43283154
[2-(2,4-difluorophenoxy)quinolin-3-yl]methanamine
CID 28965955
[2-(2-bromo-4-fluorophenoxy)quinolin-3-yl]methanamine
CID 28965989
[2-[(6-methyl-3-pyridinyl)oxy]quinolin-3-yl]methanamine
CID 62073251
[2-(3-iodophenoxy)quinolin-3-yl]methanamine
CID 43327394
2-[2-(4-chlorophenoxy)quinolin-3-yl]ethanamine
CID 63804294
[2-(2-fluoro-5-methylphenoxy)quinolin-3-yl]methanamine
CID 64854395
[4-[3-(hydroxymethyl)quinolin-2-yl]oxyphenyl]methanol
CID 61229145
[2-(2,4-dibromophenoxy)quinolin-3-yl]methanamine
CID 64718621
2-(4-chloro-3-fluorophenoxy)-3-(chloromethyl)quinoline
CID 82718093
[2-(3-fluoro-4-methylphenoxy)quinolin-3-yl]methanol
CID 107169696

Frequently Asked Questions

What is the IUPAC name of [2-(4-fluorophenoxy)quinolin-3-yl]methanamine?
The IUPAC name of [2-(4-fluorophenoxy)quinolin-3-yl]methanamine (CID 28966185) is [2-(4-fluorophenoxy)quinolin-3-yl]methanamine.
What is the SMILES notation for [2-(4-fluorophenoxy)quinolin-3-yl]methanamine?
The canonical SMILES for [2-(4-fluorophenoxy)quinolin-3-yl]methanamine is NCc1cc2ccccc2nc1Oc1ccc(F)cc1.
What is the InChIKey of [2-(4-fluorophenoxy)quinolin-3-yl]methanamine?
The InChIKey is YOXCAZXKLXPCHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13FN2O/c17-13-5-7-14(8-6-13)20-16-12(10-18)9-11-3-1-2-4-15(11)19-16/h1-9H,10,18H2.
What are the key properties of [2-(4-fluorophenoxy)quinolin-3-yl]methanamine?
[2-(4-fluorophenoxy)quinolin-3-yl]methanamine has a molecular weight of 268.29 g/mol, XLogP of 3.62, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4-fluorophenoxy)quinolin-3-yl]methanamine is sourced from PubChem (CID 28966185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).