8-fluoroquinolin-4-amine

C9H7FN2 — CID 15790504

IUPAC8-fluoroquinolin-4-amine
SMILESNc1ccnc2c(F)cccc12
InChIInChI=1S/C9H7FN2/c10-7-3-1-2-6-8(11)4-5-12-9(6)7/h1-5H,(H2,11,12)
InChIKeyPFULPFXDXVNQCQ-UHFFFAOYSA-N
MW162.17 g/mol
LogP1.96
Rot. Bonds

About 8-fluoroquinolin-4-amine

8-fluoroquinolin-4-amine (PubChem CID 15790504) has the molecular formula C9H7FN2 and a molecular weight of 162.17 g/mol. Its IUPAC name is 8-fluoroquinolin-4-amine.

Molecular Properties

Compound Name8-fluoroquinolin-4-amine
PubChem CID15790504
Molecular FormulaC9H7FN2
Molecular Weight162.17 g/mol
Exact Mass162.06
IUPAC Name8-fluoroquinolin-4-amine
SMILESNc1ccnc2c(F)cccc12
InChIInChI=1S/C9H7FN2/c10-7-3-1-2-6-8(11)4-5-12-9(6)7/h1-5H,(H2,11,12)
InChIKeyPFULPFXDXVNQCQ-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 8-fluoroquinolin-4-amine?
The IUPAC name of 8-fluoroquinolin-4-amine (CID 15790504) is 8-fluoroquinolin-4-amine.
What is the SMILES notation for 8-fluoroquinolin-4-amine?
The canonical SMILES for 8-fluoroquinolin-4-amine is Nc1ccnc2c(F)cccc12.
What is the InChIKey of 8-fluoroquinolin-4-amine?
The InChIKey is PFULPFXDXVNQCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7FN2/c10-7-3-1-2-6-8(11)4-5-12-9(6)7/h1-5H,(H2,11,12).
What are the key properties of 8-fluoroquinolin-4-amine?
8-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 8-fluoroquinolin-4-amine is sourced from PubChem (CID 15790504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).