6-fluoro-1-methoxyisoquinolin-4-amine

C10H9FN2O — CID 84663819

IUPAC6-fluoro-1-methoxyisoquinolin-4-amine
SMILESCOc1ncc(N)c2cc(F)ccc12
InChIInChI=1S/C10H9FN2O/c1-14-10-7-3-2-6(11)4-8(7)9(12)5-13-10/h2-5H,12H2,1H3
InChIKeyXANPGVDAECFPMZ-UHFFFAOYSA-N
MW192.19 g/mol
LogP1.96
Rot. Bonds1

About 6-fluoro-1-methoxyisoquinolin-4-amine

6-fluoro-1-methoxyisoquinolin-4-amine (PubChem CID 84663819) has the molecular formula C10H9FN2O and a molecular weight of 192.19 g/mol. Its IUPAC name is 6-fluoro-1-methoxyisoquinolin-4-amine.

Molecular Properties

Compound Name6-fluoro-1-methoxyisoquinolin-4-amine
PubChem CID84663819
Molecular FormulaC10H9FN2O
Molecular Weight192.19 g/mol
Exact Mass192.07
IUPAC Name6-fluoro-1-methoxyisoquinolin-4-amine
SMILESCOc1ncc(N)c2cc(F)ccc12
InChIInChI=1S/C10H9FN2O/c1-14-10-7-3-2-6(11)4-8(7)9(12)5-13-10/h2-5H,12H2,1H3
InChIKeyXANPGVDAECFPMZ-UHFFFAOYSA-N
XLogP1.96
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.19
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-fluoro-6-methoxy-5-methylpyridin-3-amine
CID 172993259
5-(4-fluorophenyl)-6-methoxypyridin-3-amine
CID 46311843
5-(3,6-difluoro-2-pyridinyl)-2-methoxypyridin-3-amine
CID 177245437
4-bromo-1-methoxy-6-methylisoquinoline
CID 84707543
2-(4-fluorophenoxy)-5-methylpyridin-3-amine
CID 66279784
5-fluoro-2,6-dimethoxypyridin-3-amine
CID 150134011
4,7-difluoronaphthalen-1-amine
CID 115015314
4-fluoro-2-(6-methoxyisoquinolin-1-yl)oxyaniline
CID 106540081
2-(2,6-dimethoxyphenoxy)-4-fluoroaniline
CID 62376643
2-(5-fluoro-6-methoxy-3-pyridinyl)-5-methyl-1,3-thiazol-4-amine
CID 118370314
5-bromo-2-(2-chloro-4-fluorophenoxy)pyridin-3-amine
CID 61228304
4-(5-fluoro-2-methoxyphenyl)pyridin-3-amine
CID 70663373

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-1-methoxyisoquinolin-4-amine?
The IUPAC name of 6-fluoro-1-methoxyisoquinolin-4-amine (CID 84663819) is 6-fluoro-1-methoxyisoquinolin-4-amine.
What is the SMILES notation for 6-fluoro-1-methoxyisoquinolin-4-amine?
The canonical SMILES for 6-fluoro-1-methoxyisoquinolin-4-amine is COc1ncc(N)c2cc(F)ccc12.
What is the InChIKey of 6-fluoro-1-methoxyisoquinolin-4-amine?
The InChIKey is XANPGVDAECFPMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9FN2O/c1-14-10-7-3-2-6(11)4-8(7)9(12)5-13-10/h2-5H,12H2,1H3.
What are the key properties of 6-fluoro-1-methoxyisoquinolin-4-amine?
6-fluoro-1-methoxyisoquinolin-4-amine has a molecular weight of 192.19 g/mol, XLogP of 1.96, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-1-methoxyisoquinolin-4-amine is sourced from PubChem (CID 84663819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).