8-fluoro-N-(6-methoxy-3-pyridinyl)quinolin-2-amine

C15H12FN3O — CID 139422667

IUPAC8-fluoro-N-(6-methoxy-3-pyridinyl)quinolin-2-amine
SMILESCOc1ccc(Nc2ccc3cccc(F)c3n2)cn1
InChIInChI=1S/C15H12FN3O/c1-20-14-8-6-11(9-17-14)18-13-7-5-10-3-2-4-12(16)15(10)19-13/h2-9H,1H3,(H,18,19)
InChIKeyRHPCODHQFPSMGJ-UHFFFAOYSA-N
MW269.28 g/mol
LogP3.52
Rot. Bonds3

About 8-fluoro-N-(6-methoxy-3-pyridinyl)quinolin-2-amine

8-fluoro-N-(6-methoxy-3-pyridinyl)quinolin-2-amine (PubChem CID 139422667) has the molecular formula C15H12FN3O and a molecular weight of 269.28 g/mol. Its IUPAC name is 8-fluoro-N-(6-methoxy-3-pyridinyl)quinolin-2-amine.

Molecular Properties

Compound Name8-fluoro-N-(6-methoxy-3-pyridinyl)quinolin-2-amine
PubChem CID139422667
Molecular FormulaC15H12FN3O
Molecular Weight269.28 g/mol
Exact Mass269.10
IUPAC Name8-fluoro-N-(6-methoxy-3-pyridinyl)quinolin-2-amine
SMILESCOc1ccc(Nc2ccc3cccc(F)c3n2)cn1
InChIInChI=1S/C15H12FN3O/c1-20-14-8-6-11(9-17-14)18-13-7-5-10-3-2-4-12(16)15(10)19-13/h2-9H,1H3,(H,18,19)
InChIKeyRHPCODHQFPSMGJ-UHFFFAOYSA-N
XLogP3.52
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.28
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 8-fluoro-N-(6-methoxy-3-pyridinyl)quinolin-2-amine?
The IUPAC name of 8-fluoro-N-(6-methoxy-3-pyridinyl)quinolin-2-amine (CID 139422667) is 8-fluoro-N-(6-methoxy-3-pyridinyl)quinolin-2-amine.
What is the SMILES notation for 8-fluoro-N-(6-methoxy-3-pyridinyl)quinolin-2-amine?
The canonical SMILES for 8-fluoro-N-(6-methoxy-3-pyridinyl)quinolin-2-amine is COc1ccc(Nc2ccc3cccc(F)c3n2)cn1.
What is the InChIKey of 8-fluoro-N-(6-methoxy-3-pyridinyl)quinolin-2-amine?
The InChIKey is RHPCODHQFPSMGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12FN3O/c1-20-14-8-6-11(9-17-14)18-13-7-5-10-3-2-4-12(16)15(10)19-13/h2-9H,1H3,(H,18,19).
What are the key properties of 8-fluoro-N-(6-methoxy-3-pyridinyl)quinolin-2-amine?
8-fluoro-N-(6-methoxy-3-pyridinyl)quinolin-2-amine has a molecular weight of 269.28 g/mol, XLogP of 3.52, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-fluoro-N-(6-methoxy-3-pyridinyl)quinolin-2-amine is sourced from PubChem (CID 139422667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).