(4-methoxy-2-quinolin-5-yloxyphenyl)methanamine

C17H16N2O2 — CID 103043786

IUPAC(4-methoxy-2-quinolin-5-yloxyphenyl)methanamine
SMILESCOc1ccc(CN)c(Oc2cccc3ncccc23)c1
InChIInChI=1S/C17H16N2O2/c1-20-13-8-7-12(11-18)17(10-13)21-16-6-2-5-15-14(16)4-3-9-19-15/h2-10H,11,18H2,1H3
InChIKeyVDZFXGXBIUDNGQ-UHFFFAOYSA-N
MW280.33 g/mol
LogP3.49
Rot. Bonds4

About (4-methoxy-2-quinolin-5-yloxyphenyl)methanamine

(4-methoxy-2-quinolin-5-yloxyphenyl)methanamine (PubChem CID 103043786) has the molecular formula C17H16N2O2 and a molecular weight of 280.33 g/mol. Its IUPAC name is (4-methoxy-2-quinolin-5-yloxyphenyl)methanamine.

Molecular Properties

Compound Name(4-methoxy-2-quinolin-5-yloxyphenyl)methanamine
PubChem CID103043786
Molecular FormulaC17H16N2O2
Molecular Weight280.33 g/mol
Exact Mass280.12
IUPAC Name(4-methoxy-2-quinolin-5-yloxyphenyl)methanamine
SMILESCOc1ccc(CN)c(Oc2cccc3ncccc23)c1
InChIInChI=1S/C17H16N2O2/c1-20-13-8-7-12(11-18)17(10-13)21-16-6-2-5-15-14(16)4-3-9-19-15/h2-10H,11,18H2,1H3
InChIKeyVDZFXGXBIUDNGQ-UHFFFAOYSA-N
XLogP3.49
TPSA57.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.33
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[4-methoxy-2-[(2-methyl-3-pyridinyl)oxy]phenyl]methanamine
CID 81300033
5-(4-methoxyphenoxy)quinoline
CID 122457274
(4-methyl-3-quinolin-5-yloxyphenyl)methanamine
CID 103045285
(4-methoxy-2-pyridin-3-yloxyphenyl)methanamine
CID 81299641
2-methoxy-6-quinolin-5-yloxyaniline
CID 103043894
5-[2-bromo-4-(2-methoxyethoxy)phenoxy]quinoline
CID 145139401
[5-fluoro-2-(quinolin-5-yloxymethyl)phenyl]methanamine
CID 103044344
[5-methoxy-2-(pyrimidin-2-ylmethoxy)phenyl]methanamine
CID 62697998
[2-(5-fluoro-2-methylphenoxy)-4-methoxyphenyl]methanamine
CID 102980112
[4-methoxy-2-[(1-methyl-1,2,4-triazol-3-yl)oxy]phenyl]methanamine
CID 106596411
2-quinolin-5-yloxypyridin-3-amine
CID 103043871
6-(3-methoxyphenoxy)quinolin-5-amine
CID 43809791

Frequently Asked Questions

What is the IUPAC name of (4-methoxy-2-quinolin-5-yloxyphenyl)methanamine?
The IUPAC name of (4-methoxy-2-quinolin-5-yloxyphenyl)methanamine (CID 103043786) is (4-methoxy-2-quinolin-5-yloxyphenyl)methanamine.
What is the SMILES notation for (4-methoxy-2-quinolin-5-yloxyphenyl)methanamine?
The canonical SMILES for (4-methoxy-2-quinolin-5-yloxyphenyl)methanamine is COc1ccc(CN)c(Oc2cccc3ncccc23)c1.
What is the InChIKey of (4-methoxy-2-quinolin-5-yloxyphenyl)methanamine?
The InChIKey is VDZFXGXBIUDNGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O2/c1-20-13-8-7-12(11-18)17(10-13)21-16-6-2-5-15-14(16)4-3-9-19-15/h2-10H,11,18H2,1H3.
What are the key properties of (4-methoxy-2-quinolin-5-yloxyphenyl)methanamine?
(4-methoxy-2-quinolin-5-yloxyphenyl)methanamine has a molecular weight of 280.33 g/mol, XLogP of 3.49, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methoxy-2-quinolin-5-yloxyphenyl)methanamine is sourced from PubChem (CID 103043786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).