QDI

6-fluoroquinolin-4-amine

Created: 2022-06-07
Last modified:  2023-11-08

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Chemical Details

Formal Charge0
Atom Count19
Chiral Atom Count0
Bond Count20
Aromatic Bond Count11
2D diagram of QDI

Chemical Component Summary

Name6-fluoroquinolin-4-amine
Systematic Name (OpenEye OEToolkits)6-fluoranylquinolin-4-amine
FormulaC9 H7 F N2
Molecular Weight162.164
TypeNON-POLYMER

Chemical Descriptors

TypeProgram Version Descriptor
SMILESACDLabs12.01Fc1ccc2nccc(N)c2c1
SMILESCACTVS3.385Nc1ccnc2ccc(F)cc12
SMILESOpenEye OEToolkits2.0.7c1cc2c(cc1F)c(ccn2)N
Canonical SMILESCACTVS3.385 Nc1ccnc2ccc(F)cc12
Canonical SMILESOpenEye OEToolkits2.0.7 c1cc2c(cc1F)c(ccn2)N
InChIInChI1.03 InChI=1S/C9H7FN2/c10-6-1-2-9-7(5-6)8(11)3-4-12-9/h1-5H,(H2,11,12)
InChIKeyInChI1.03 HDANYIGFTBVIBA-UHFFFAOYSA-N

Related Resource References

Resource NameReference
PubChem 17028180