3-[(2-fluoro-6-methoxyphenyl)methyl]quinolin-2-amine

C17H15FN2O — CID 25227515

IUPAC3-[(2-fluoro-6-methoxyphenyl)methyl]quinolin-2-amine
SMILESCOc1cccc(F)c1Cc1cc2ccccc2nc1N
InChIInChI=1S/C17H15FN2O/c1-21-16-8-4-6-14(18)13(16)10-12-9-11-5-2-3-7-15(11)20-17(12)19/h2-9H,10H2,1H3,(H2,19,20)
InChIKeyZHGLCRKIVNFDAO-UHFFFAOYSA-N
MW282.32 g/mol
LogP3.56
Rot. Bonds3

About 3-[(2-fluoro-6-methoxyphenyl)methyl]quinolin-2-amine

3-[(2-fluoro-6-methoxyphenyl)methyl]quinolin-2-amine (PubChem CID 25227515) has the molecular formula C17H15FN2O and a molecular weight of 282.32 g/mol. Its IUPAC name is 3-[(2-fluoro-6-methoxyphenyl)methyl]quinolin-2-amine.

Molecular Properties

Compound Name3-[(2-fluoro-6-methoxyphenyl)methyl]quinolin-2-amine
PubChem CID25227515
Molecular FormulaC17H15FN2O
Molecular Weight282.32 g/mol
Exact Mass282.12
IUPAC Name3-[(2-fluoro-6-methoxyphenyl)methyl]quinolin-2-amine
SMILESCOc1cccc(F)c1Cc1cc2ccccc2nc1N
InChIInChI=1S/C17H15FN2O/c1-21-16-8-4-6-14(18)13(16)10-12-9-11-5-2-3-7-15(11)20-17(12)19/h2-9H,10H2,1H3,(H2,19,20)
InChIKeyZHGLCRKIVNFDAO-UHFFFAOYSA-N
XLogP3.56
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 ≤ 53.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[(2-ethoxy-6-fluorophenyl)methyl]quinolin-2-amine;hydrochloride
CID 68550592
3-[(2-fluoro-6-methoxyphenyl)methyl]-1,5-naphthyridin-2-amine
CID 68552739
3-[(2,6-difluorophenoxy)methyl]quinolin-2-amine
CID 81265271
3-[(2-ethoxyphenyl)methyl]quinolin-2-amine;hydrochloride
CID 68554141
8-methoxy-3-[(2-methoxyphenyl)methyl]quinolin-2-amine
CID 68554779
(2-fluoro-6-methoxyphenyl)methanamine
CID 40786958
[2-(2,3-difluorophenoxy)quinolin-3-yl]methanol
CID 63036604
3-[(2,6-dimethoxyphenyl)methyl]pyridin-2-amine
CID 116811036
3-(3,4-dimethoxyphenyl)quinolin-2-amine
CID 1480774
3-[(2-fluoro-6-methoxyphenyl)methyl]-[1,2,4]triazolo[4,3-a]pyridin-5-amine
CID 138707245
[2-[(2-aminoquinolin-3-yl)methoxy]phenyl]methanol
CID 63680015
3-methoxy-2-[(2-methoxyphenyl)methyl]aniline
CID 13379479

Frequently Asked Questions

What is the IUPAC name of 3-[(2-fluoro-6-methoxyphenyl)methyl]quinolin-2-amine?
The IUPAC name of 3-[(2-fluoro-6-methoxyphenyl)methyl]quinolin-2-amine (CID 25227515) is 3-[(2-fluoro-6-methoxyphenyl)methyl]quinolin-2-amine.
What is the SMILES notation for 3-[(2-fluoro-6-methoxyphenyl)methyl]quinolin-2-amine?
The canonical SMILES for 3-[(2-fluoro-6-methoxyphenyl)methyl]quinolin-2-amine is COc1cccc(F)c1Cc1cc2ccccc2nc1N.
What is the InChIKey of 3-[(2-fluoro-6-methoxyphenyl)methyl]quinolin-2-amine?
The InChIKey is ZHGLCRKIVNFDAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15FN2O/c1-21-16-8-4-6-14(18)13(16)10-12-9-11-5-2-3-7-15(11)20-17(12)19/h2-9H,10H2,1H3,(H2,19,20).
What are the key properties of 3-[(2-fluoro-6-methoxyphenyl)methyl]quinolin-2-amine?
3-[(2-fluoro-6-methoxyphenyl)methyl]quinolin-2-amine has a molecular weight of 282.32 g/mol, XLogP of 3.56, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-fluoro-6-methoxyphenyl)methyl]quinolin-2-amine is sourced from PubChem (CID 25227515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).