[5-fluoro-2-(quinolin-5-yloxymethyl)phenyl]methanamine

C17H15FN2O — CID 103044344

IUPAC[5-fluoro-2-(quinolin-5-yloxymethyl)phenyl]methanamine
SMILESNCc1cc(F)ccc1COc1cccc2ncccc12
InChIInChI=1S/C17H15FN2O/c18-14-7-6-12(13(9-14)10-19)11-21-17-5-1-4-16-15(17)3-2-8-20-16/h1-9H,10-11,19H2
InChIKeyGNTVLVXHIXJMCO-UHFFFAOYSA-N
MW282.32 g/mol
LogP3.41
Rot. Bonds4

About [5-fluoro-2-(quinolin-5-yloxymethyl)phenyl]methanamine

[5-fluoro-2-(quinolin-5-yloxymethyl)phenyl]methanamine (PubChem CID 103044344) has the molecular formula C17H15FN2O and a molecular weight of 282.32 g/mol. Its IUPAC name is [5-fluoro-2-(quinolin-5-yloxymethyl)phenyl]methanamine.

Molecular Properties

Compound Name[5-fluoro-2-(quinolin-5-yloxymethyl)phenyl]methanamine
PubChem CID103044344
Molecular FormulaC17H15FN2O
Molecular Weight282.32 g/mol
Exact Mass282.12
IUPAC Name[5-fluoro-2-(quinolin-5-yloxymethyl)phenyl]methanamine
SMILESNCc1cc(F)ccc1COc1cccc2ncccc12
InChIInChI=1S/C17H15FN2O/c18-14-7-6-12(13(9-14)10-19)11-21-17-5-1-4-16-15(17)3-2-8-20-16/h1-9H,10-11,19H2
InChIKeyGNTVLVXHIXJMCO-UHFFFAOYSA-N
XLogP3.41
TPSA48.14 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 ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-fluoro-4-(quinolin-5-yloxymethyl)aniline
CID 103044079
5-chloro-2-(quinolin-5-yloxymethyl)aniline
CID 103044256
5-[(2-bromo-3-fluorophenyl)methoxy]quinoline
CID 103045464
[5-fluoro-2-(quinolin-8-ylmethoxy)phenyl]methanamine
CID 107695009
5-[(4,6-dichloro-3-pyridinyl)methoxy]quinoline
CID 103044604
(4-methoxy-2-quinolin-5-yloxyphenyl)methanamine
CID 103043786
1-(5-fluoro-2-quinolin-5-yloxyphenyl)-N-methylmethanamine
CID 103045289
4-(quinolin-5-yloxymethyl)pyridine-2-carbothioamide
CID 103044812
[4-fluoro-2-[(2-methylphenoxy)methyl]phenyl]methanamine
CID 64763729
[2-[(2,4-difluorophenoxy)methyl]phenyl]methanamine
CID 16791044
[2-(aminomethyl)-4-fluorophenyl]methanamine
CID 44784876
O-quinolin-5-ylhydroxylamine;hydrochloride
CID 162421843

Frequently Asked Questions

What is the IUPAC name of [5-fluoro-2-(quinolin-5-yloxymethyl)phenyl]methanamine?
The IUPAC name of [5-fluoro-2-(quinolin-5-yloxymethyl)phenyl]methanamine (CID 103044344) is [5-fluoro-2-(quinolin-5-yloxymethyl)phenyl]methanamine.
What is the SMILES notation for [5-fluoro-2-(quinolin-5-yloxymethyl)phenyl]methanamine?
The canonical SMILES for [5-fluoro-2-(quinolin-5-yloxymethyl)phenyl]methanamine is NCc1cc(F)ccc1COc1cccc2ncccc12.
What is the InChIKey of [5-fluoro-2-(quinolin-5-yloxymethyl)phenyl]methanamine?
The InChIKey is GNTVLVXHIXJMCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15FN2O/c18-14-7-6-12(13(9-14)10-19)11-21-17-5-1-4-16-15(17)3-2-8-20-16/h1-9H,10-11,19H2.
What are the key properties of [5-fluoro-2-(quinolin-5-yloxymethyl)phenyl]methanamine?
[5-fluoro-2-(quinolin-5-yloxymethyl)phenyl]methanamine has a molecular weight of 282.32 g/mol, XLogP of 3.41, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [5-fluoro-2-(quinolin-5-yloxymethyl)phenyl]methanamine is sourced from PubChem (CID 103044344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).