5-[(4-fluorophenyl)methoxy]quinolin-8-amine

C16H13FN2O — CID 116524613

IUPAC5-[(4-fluorophenyl)methoxy]quinolin-8-amine
SMILESNc1ccc(OCc2ccc(F)cc2)c2cccnc12
InChIInChI=1S/C16H13FN2O/c17-12-5-3-11(4-6-12)10-20-15-8-7-14(18)16-13(15)2-1-9-19-16/h1-9H,10,18H2
InChIKeyJCCBFZJGHWHQRP-UHFFFAOYSA-N
MW268.29 g/mol
LogP3.54
Rot. Bonds3

About 5-[(4-fluorophenyl)methoxy]quinolin-8-amine

5-[(4-fluorophenyl)methoxy]quinolin-8-amine (PubChem CID 116524613) has the molecular formula C16H13FN2O and a molecular weight of 268.29 g/mol. Its IUPAC name is 5-[(4-fluorophenyl)methoxy]quinolin-8-amine.

Molecular Properties

Compound Name5-[(4-fluorophenyl)methoxy]quinolin-8-amine
PubChem CID116524613
Molecular FormulaC16H13FN2O
Molecular Weight268.29 g/mol
Exact Mass268.10
IUPAC Name5-[(4-fluorophenyl)methoxy]quinolin-8-amine
SMILESNc1ccc(OCc2ccc(F)cc2)c2cccnc12
InChIInChI=1S/C16H13FN2O/c17-12-5-3-11(4-6-12)10-20-15-8-7-14(18)16-13(15)2-1-9-19-16/h1-9H,10,18H2
InChIKeyJCCBFZJGHWHQRP-UHFFFAOYSA-N
XLogP3.54
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.29
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

5-(pyrimidin-2-ylmethoxy)quinolin-8-amine
CID 116524814
5-[(2,6-difluorophenyl)methoxy]quinolin-8-amine
CID 114929956
5-(thiophen-3-ylmethoxy)quinolin-8-amine
CID 116524803
5-(methoxymethoxy)quinolin-8-amine
CID 116524711
5-(5-fluoropyrimidin-2-yl)oxyquinolin-8-amine
CID 116525609
8-(pyridin-3-ylmethoxy)quinolin-5-amine
CID 60863689
8-[(5-fluoro-2-methylphenyl)methoxy]quinolin-5-amine
CID 105369730
2-(8-aminoquinolin-5-yl)oxyacetamide
CID 116524742
5-(3-pyridin-4-ylpropoxy)quinolin-8-amine
CID 43449674
5-[(2-propan-2-yl-1,2,4-triazol-3-yl)methoxy]quinolin-8-amine
CID 116524713
5-[(2,5-dimethylphenyl)methoxy]quinolin-8-amine
CID 116524807
5-(3,3-dimethylbutoxy)quinolin-8-amine
CID 66233789

Frequently Asked Questions

What is the IUPAC name of 5-[(4-fluorophenyl)methoxy]quinolin-8-amine?
The IUPAC name of 5-[(4-fluorophenyl)methoxy]quinolin-8-amine (CID 116524613) is 5-[(4-fluorophenyl)methoxy]quinolin-8-amine.
What is the SMILES notation for 5-[(4-fluorophenyl)methoxy]quinolin-8-amine?
The canonical SMILES for 5-[(4-fluorophenyl)methoxy]quinolin-8-amine is Nc1ccc(OCc2ccc(F)cc2)c2cccnc12.
What is the InChIKey of 5-[(4-fluorophenyl)methoxy]quinolin-8-amine?
The InChIKey is JCCBFZJGHWHQRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13FN2O/c17-12-5-3-11(4-6-12)10-20-15-8-7-14(18)16-13(15)2-1-9-19-16/h1-9H,10,18H2.
What are the key properties of 5-[(4-fluorophenyl)methoxy]quinolin-8-amine?
5-[(4-fluorophenyl)methoxy]quinolin-8-amine has a molecular weight of 268.29 g/mol, XLogP of 3.54, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(4-fluorophenyl)methoxy]quinolin-8-amine is sourced from PubChem (CID 116524613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).