1-[2-(4-fluorophenoxy)quinolin-3-yl]-N-methylmethanamine

C17H15FN2O — CID 43283154

IUPAC1-[2-(4-fluorophenoxy)quinolin-3-yl]-N-methylmethanamine
SMILESCNCc1cc2ccccc2nc1Oc1ccc(F)cc1
InChIInChI=1S/C17H15FN2O/c1-19-11-13-10-12-4-2-3-5-16(12)20-17(13)21-15-8-6-14(18)7-9-15/h2-10,19H,11H2,1H3
InChIKeyABUJSLWIYOJEJF-UHFFFAOYSA-N
MW282.32 g/mol
LogP3.89
Rot. Bonds4

About 1-[2-(4-fluorophenoxy)quinolin-3-yl]-N-methylmethanamine

1-[2-(4-fluorophenoxy)quinolin-3-yl]-N-methylmethanamine (PubChem CID 43283154) has the molecular formula C17H15FN2O and a molecular weight of 282.32 g/mol. Its IUPAC name is 1-[2-(4-fluorophenoxy)quinolin-3-yl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[2-(4-fluorophenoxy)quinolin-3-yl]-N-methylmethanamine
PubChem CID43283154
Molecular FormulaC17H15FN2O
Molecular Weight282.32 g/mol
Exact Mass282.12
IUPAC Name1-[2-(4-fluorophenoxy)quinolin-3-yl]-N-methylmethanamine
SMILESCNCc1cc2ccccc2nc1Oc1ccc(F)cc1
InChIInChI=1S/C17H15FN2O/c1-19-11-13-10-12-4-2-3-5-16(12)20-17(13)21-15-8-6-14(18)7-9-15/h2-10,19H,11H2,1H3
InChIKeyABUJSLWIYOJEJF-UHFFFAOYSA-N
XLogP3.89
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.32
LogP ≤ 53.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-[2-(4-fluorophenoxy)quinolin-3-yl]-N-methylmethanamine 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-fluorophenoxy)quinolin-3-yl]methanamine
CID 28966185
N-methyl-1-[4-(3-methylquinolin-2-yl)oxyphenyl]methanamine
CID 106486733
[2-(4-methylsulfanylphenoxy)quinolin-3-yl]methanamine
CID 63648716
[4-[3-(hydroxymethyl)quinolin-2-yl]oxyphenyl]methanol
CID 61229145
[2-(3-fluoro-4-methylphenoxy)quinolin-3-yl]methanol
CID 107169696
4-[3-(chloromethyl)quinolin-2-yl]oxybenzonitrile
CID 28964839
[2-(2,4-difluorophenoxy)quinolin-3-yl]methanamine
CID 28965955
2-[2-(4-chlorophenoxy)quinolin-3-yl]ethanamine
CID 63804294
2-(4-chloro-3-fluorophenoxy)-3-(chloromethyl)quinoline
CID 82718093
[2-(2-bromo-4-fluorophenoxy)quinolin-3-yl]methanamine
CID 28965989
[2-[3-(hydroxymethyl)quinolin-2-yl]oxyphenyl]methanol
CID 63653966
2-(4-fluorophenoxy)-3-[3-(trifluoromethyl)phenyl]quinoline
CID 2765463

Frequently Asked Questions

What is the IUPAC name of 1-[2-(4-fluorophenoxy)quinolin-3-yl]-N-methylmethanamine?
The IUPAC name of 1-[2-(4-fluorophenoxy)quinolin-3-yl]-N-methylmethanamine (CID 43283154) is 1-[2-(4-fluorophenoxy)quinolin-3-yl]-N-methylmethanamine.
What is the SMILES notation for 1-[2-(4-fluorophenoxy)quinolin-3-yl]-N-methylmethanamine?
The canonical SMILES for 1-[2-(4-fluorophenoxy)quinolin-3-yl]-N-methylmethanamine is CNCc1cc2ccccc2nc1Oc1ccc(F)cc1.
What is the InChIKey of 1-[2-(4-fluorophenoxy)quinolin-3-yl]-N-methylmethanamine?
The InChIKey is ABUJSLWIYOJEJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15FN2O/c1-19-11-13-10-12-4-2-3-5-16(12)20-17(13)21-15-8-6-14(18)7-9-15/h2-10,19H,11H2,1H3.
What are the key properties of 1-[2-(4-fluorophenoxy)quinolin-3-yl]-N-methylmethanamine?
1-[2-(4-fluorophenoxy)quinolin-3-yl]-N-methylmethanamine has a molecular weight of 282.32 g/mol, XLogP of 3.89, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(4-fluorophenoxy)quinolin-3-yl]-N-methylmethanamine is sourced from PubChem (CID 43283154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).