1-(5-fluoro-2-quinolin-8-yloxyphenyl)ethanamine

C17H15FN2O — CID 43212382

IUPAC1-(5-fluoro-2-quinolin-8-yloxyphenyl)ethanamine
SMILESCC(N)c1cc(F)ccc1Oc1cccc2cccnc12
InChIInChI=1S/C17H15FN2O/c1-11(19)14-10-13(18)7-8-15(14)21-16-6-2-4-12-5-3-9-20-17(12)16/h2-11H,19H2,1H3
InChIKeyFVAKVQVQFJIZEE-UHFFFAOYSA-N
MW282.32 g/mol
LogP4.19
Rot. Bonds3

About 1-(5-fluoro-2-quinolin-8-yloxyphenyl)ethanamine

1-(5-fluoro-2-quinolin-8-yloxyphenyl)ethanamine (PubChem CID 43212382) has the molecular formula C17H15FN2O and a molecular weight of 282.32 g/mol. Its IUPAC name is 1-(5-fluoro-2-quinolin-8-yloxyphenyl)ethanamine.

Molecular Properties

Compound Name1-(5-fluoro-2-quinolin-8-yloxyphenyl)ethanamine
PubChem CID43212382
Molecular FormulaC17H15FN2O
Molecular Weight282.32 g/mol
Exact Mass282.12
IUPAC Name1-(5-fluoro-2-quinolin-8-yloxyphenyl)ethanamine
SMILESCC(N)c1cc(F)ccc1Oc1cccc2cccnc12
InChIInChI=1S/C17H15FN2O/c1-11(19)14-10-13(18)7-8-15(14)21-16-6-2-4-12-5-3-9-20-17(12)16/h2-11H,19H2,1H3
InChIKeyFVAKVQVQFJIZEE-UHFFFAOYSA-N
XLogP4.19
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.32
LogP ≤ 54.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(1R)-1-(5-fluoro-2-quinolin-8-yloxyphenyl)ethanol
CID 63372518
(1R)-1-(2-quinolin-8-yloxyphenyl)ethanol
CID 63372301
(1S)-1-(2-quinolin-8-yloxyphenyl)propan-1-amine
CID 103959274
1-(5-fluoro-2-quinolin-8-yloxyphenyl)-N-methylmethanamine
CID 43314311
1-[5-fluoro-2-(2-methylsulfanylphenoxy)phenyl]ethanamine
CID 63649355
(1R)-1-[2-(4-chloro-2-methylphenoxy)-5-fluorophenyl]ethanamine
CID 29275289
2-[2-[(1S)-1-aminoethyl]-4-fluorophenoxy]-6-fluorobenzonitrile
CID 78938120
(1R)-1-[2-(2-chloro-4-fluorophenoxy)-3-pyridinyl]ethanamine
CID 114056675
(1S)-1-[2-(4-bromo-2-fluorophenoxy)-5-fluorophenyl]ethanamine
CID 28971365
(2S,3S)-butane-2,3-diamine;1,10-phenanthroline;platinum(2+)
CID 59769200
3-[2-(1-aminoethyl)-4-fluorophenoxy]-N,N-dimethylaniline
CID 61229682
3-[2-[(1S)-1-aminoethyl]-4-fluorophenoxy]-N,N-dimethylaniline
CID 78938251

Frequently Asked Questions

What is the IUPAC name of 1-(5-fluoro-2-quinolin-8-yloxyphenyl)ethanamine?
The IUPAC name of 1-(5-fluoro-2-quinolin-8-yloxyphenyl)ethanamine (CID 43212382) is 1-(5-fluoro-2-quinolin-8-yloxyphenyl)ethanamine.
What is the SMILES notation for 1-(5-fluoro-2-quinolin-8-yloxyphenyl)ethanamine?
The canonical SMILES for 1-(5-fluoro-2-quinolin-8-yloxyphenyl)ethanamine is CC(N)c1cc(F)ccc1Oc1cccc2cccnc12.
What is the InChIKey of 1-(5-fluoro-2-quinolin-8-yloxyphenyl)ethanamine?
The InChIKey is FVAKVQVQFJIZEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15FN2O/c1-11(19)14-10-13(18)7-8-15(14)21-16-6-2-4-12-5-3-9-20-17(12)16/h2-11H,19H2,1H3.
What are the key properties of 1-(5-fluoro-2-quinolin-8-yloxyphenyl)ethanamine?
1-(5-fluoro-2-quinolin-8-yloxyphenyl)ethanamine has a molecular weight of 282.32 g/mol, XLogP of 4.19, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-fluoro-2-quinolin-8-yloxyphenyl)ethanamine is sourced from PubChem (CID 43212382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).