2-fluoro-6-morpholin-4-ylpyridin-3-amine

C9H12FN3O — CID 118234472

IUPAC2-fluoro-6-morpholin-4-ylpyridin-3-amine
SMILESNc1ccc(N2CCOCC2)nc1F
InChIInChI=1S/C9H12FN3O/c10-9-7(11)1-2-8(12-9)13-3-5-14-6-4-13/h1-2H,3-6,11H2
InChIKeyUPMHRYZJSDGEFL-UHFFFAOYSA-N
MW197.21 g/mol
LogP0.64
Rot. Bonds1

About 2-fluoro-6-morpholin-4-ylpyridin-3-amine

2-fluoro-6-morpholin-4-ylpyridin-3-amine (PubChem CID 118234472) has the molecular formula C9H12FN3O and a molecular weight of 197.21 g/mol. Its IUPAC name is 2-fluoro-6-morpholin-4-ylpyridin-3-amine.

Molecular Properties

Compound Name2-fluoro-6-morpholin-4-ylpyridin-3-amine
PubChem CID118234472
Molecular FormulaC9H12FN3O
Molecular Weight197.21 g/mol
Exact Mass197.10
IUPAC Name2-fluoro-6-morpholin-4-ylpyridin-3-amine
SMILESNc1ccc(N2CCOCC2)nc1F
InChIInChI=1S/C9H12FN3O/c10-9-7(11)1-2-8(12-9)13-3-5-14-6-4-13/h1-2H,3-6,11H2
InChIKeyUPMHRYZJSDGEFL-UHFFFAOYSA-N
XLogP0.64
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.21
LogP ≤ 50.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-6-morpholin-4-ylpyridin-3-amine?
The IUPAC name of 2-fluoro-6-morpholin-4-ylpyridin-3-amine (CID 118234472) is 2-fluoro-6-morpholin-4-ylpyridin-3-amine.
What is the SMILES notation for 2-fluoro-6-morpholin-4-ylpyridin-3-amine?
The canonical SMILES for 2-fluoro-6-morpholin-4-ylpyridin-3-amine is Nc1ccc(N2CCOCC2)nc1F.
What is the InChIKey of 2-fluoro-6-morpholin-4-ylpyridin-3-amine?
The InChIKey is UPMHRYZJSDGEFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12FN3O/c10-9-7(11)1-2-8(12-9)13-3-5-14-6-4-13/h1-2H,3-6,11H2.
What are the key properties of 2-fluoro-6-morpholin-4-ylpyridin-3-amine?
2-fluoro-6-morpholin-4-ylpyridin-3-amine has a molecular weight of 197.21 g/mol, XLogP of 0.64, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-6-morpholin-4-ylpyridin-3-amine is sourced from PubChem (CID 118234472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).