6-fluoroquinolin-4-amine

C9H7FN2 — CID 17028180

IUPAC6-fluoroquinolin-4-amine
SMILESNc1ccnc2ccc(F)cc12
InChIInChI=1S/C9H7FN2/c10-6-1-2-9-7(5-6)8(11)3-4-12-9/h1-5H,(H2,11,12)
InChIKeyHDANYIGFTBVIBA-UHFFFAOYSA-N
MW162.17 g/mol
LogP1.96
Rot. Bonds

About 6-fluoroquinolin-4-amine

6-fluoroquinolin-4-amine (PubChem CID 17028180) has the molecular formula C9H7FN2 and a molecular weight of 162.17 g/mol. Its IUPAC name is 6-fluoroquinolin-4-amine.

Molecular Properties

Compound Name6-fluoroquinolin-4-amine
PubChem CID17028180
Molecular FormulaC9H7FN2
Molecular Weight162.17 g/mol
Exact Mass162.06
IUPAC Name6-fluoroquinolin-4-amine
SMILESNc1ccnc2ccc(F)cc12
InChIInChI=1S/C9H7FN2/c10-6-1-2-9-7(5-6)8(11)3-4-12-9/h1-5H,(H2,11,12)
InChIKeyHDANYIGFTBVIBA-UHFFFAOYSA-N
XLogP1.96
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.17
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-fluoroquinolin-4-amine?
The IUPAC name of 6-fluoroquinolin-4-amine (CID 17028180) is 6-fluoroquinolin-4-amine.
What is the SMILES notation for 6-fluoroquinolin-4-amine?
The canonical SMILES for 6-fluoroquinolin-4-amine is Nc1ccnc2ccc(F)cc12.
What is the InChIKey of 6-fluoroquinolin-4-amine?
The InChIKey is HDANYIGFTBVIBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7FN2/c10-6-1-2-9-7(5-6)8(11)3-4-12-9/h1-5H,(H2,11,12).
What are the key properties of 6-fluoroquinolin-4-amine?
6-fluoroquinolin-4-amine has a molecular weight of 162.17 g/mol, XLogP of 1.96, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoroquinolin-4-amine is sourced from PubChem (CID 17028180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).