1-(5-fluoro-2-quinolin-5-yloxyphenyl)-N-methylmethanamine

C17H15FN2O — CID 103045289

IUPAC1-(5-fluoro-2-quinolin-5-yloxyphenyl)-N-methylmethanamine
SMILESCNCc1cc(F)ccc1Oc1cccc2ncccc12
InChIInChI=1S/C17H15FN2O/c1-19-11-12-10-13(18)7-8-16(12)21-17-6-2-5-15-14(17)4-3-9-20-15/h2-10,19H,11H2,1H3
InChIKeyWTLQVAUYVWTIBM-UHFFFAOYSA-N
MW282.32 g/mol
LogP3.89
Rot. Bonds4

About 1-(5-fluoro-2-quinolin-5-yloxyphenyl)-N-methylmethanamine

1-(5-fluoro-2-quinolin-5-yloxyphenyl)-N-methylmethanamine (PubChem CID 103045289) has the molecular formula C17H15FN2O and a molecular weight of 282.32 g/mol. Its IUPAC name is 1-(5-fluoro-2-quinolin-5-yloxyphenyl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(5-fluoro-2-quinolin-5-yloxyphenyl)-N-methylmethanamine
PubChem CID103045289
Molecular FormulaC17H15FN2O
Molecular Weight282.32 g/mol
Exact Mass282.12
IUPAC Name1-(5-fluoro-2-quinolin-5-yloxyphenyl)-N-methylmethanamine
SMILESCNCc1cc(F)ccc1Oc1cccc2ncccc12
InChIInChI=1S/C17H15FN2O/c1-19-11-12-10-13(18)7-8-16(12)21-17-6-2-5-15-14(17)4-3-9-20-15/h2-10,19H,11H2,1H3
InChIKeyWTLQVAUYVWTIBM-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

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Related Compounds

1-(5-fluoro-2-quinolin-8-yloxyphenyl)-N-methylmethanamine
CID 43314311
1-[5-fluoro-2-(2-methoxyphenoxy)phenyl]-N-methylmethanamine
CID 43314262
ethane;N-methyl-1-quinolin-5-ylmethanamine
CID 163296401
1-[2-(2-tert-butylphenoxy)-5-fluorophenyl]-N-methylmethanamine
CID 43314125
[5-fluoro-2-(quinolin-5-yloxymethyl)phenyl]methanamine
CID 103044344
N-methyl-1-[2-(quinolin-5-yloxymethyl)furan-3-yl]methanamine
CID 103045766
1-[2-(3-chlorophenoxy)-5-fluorophenyl]-N-methylmethanamine
CID 43314250
1-[2-(3,5-dimethoxyphenoxy)-5-fluorophenyl]-N-methylmethanamine
CID 43589963
2-methoxy-6-quinolin-5-yloxyaniline
CID 103043894
1-[2-(5-bromo-2-fluorophenoxy)-5-fluorophenyl]-N-methylmethanamine
CID 114674362
1-[2-(3,5-dichlorophenoxy)-5-fluorophenyl]-N-methylmethanamine
CID 43622050
N,2-dimethyl-2-quinolin-5-yloxypropan-1-amine
CID 103045718

Frequently Asked Questions

What is the IUPAC name of 1-(5-fluoro-2-quinolin-5-yloxyphenyl)-N-methylmethanamine?
The IUPAC name of 1-(5-fluoro-2-quinolin-5-yloxyphenyl)-N-methylmethanamine (CID 103045289) is 1-(5-fluoro-2-quinolin-5-yloxyphenyl)-N-methylmethanamine.
What is the SMILES notation for 1-(5-fluoro-2-quinolin-5-yloxyphenyl)-N-methylmethanamine?
The canonical SMILES for 1-(5-fluoro-2-quinolin-5-yloxyphenyl)-N-methylmethanamine is CNCc1cc(F)ccc1Oc1cccc2ncccc12.
What is the InChIKey of 1-(5-fluoro-2-quinolin-5-yloxyphenyl)-N-methylmethanamine?
The InChIKey is WTLQVAUYVWTIBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15FN2O/c1-19-11-12-10-13(18)7-8-16(12)21-17-6-2-5-15-14(17)4-3-9-20-15/h2-10,19H,11H2,1H3.
What are the key properties of 1-(5-fluoro-2-quinolin-5-yloxyphenyl)-N-methylmethanamine?
1-(5-fluoro-2-quinolin-5-yloxyphenyl)-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-(5-fluoro-2-quinolin-5-yloxyphenyl)-N-methylmethanamine is sourced from PubChem (CID 103045289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).