2,5-difluoro-3-(oxan-4-yl)pyridine

C10H11F2NO — CID 58548523

IUPAC2,5-difluoro-3-(oxan-4-yl)pyridine
SMILESFc1cnc(F)c(C2CCOCC2)c1
InChIInChI=1S/C10H11F2NO/c11-8-5-9(10(12)13-6-8)7-1-3-14-4-2-7/h5-7H,1-4H2
InChIKeyREUJKMFCCZXXER-UHFFFAOYSA-N
MW199.20 g/mol
LogP2.25
Rot. Bonds1

About 2,5-difluoro-3-(oxan-4-yl)pyridine

2,5-difluoro-3-(oxan-4-yl)pyridine (PubChem CID 58548523) has the molecular formula C10H11F2NO and a molecular weight of 199.20 g/mol. Its IUPAC name is 2,5-difluoro-3-(oxan-4-yl)pyridine.

Molecular Properties

Compound Name2,5-difluoro-3-(oxan-4-yl)pyridine
PubChem CID58548523
Molecular FormulaC10H11F2NO
Molecular Weight199.20 g/mol
Exact Mass199.08
IUPAC Name2,5-difluoro-3-(oxan-4-yl)pyridine
SMILESFc1cnc(F)c(C2CCOCC2)c1
InChIInChI=1S/C10H11F2NO/c11-8-5-9(10(12)13-6-8)7-1-3-14-4-2-7/h5-7H,1-4H2
InChIKeyREUJKMFCCZXXER-UHFFFAOYSA-N
XLogP2.25
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.20
LogP ≤ 52.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 2,5-difluoro-3-(oxan-4-yl)pyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2,5-difluoro-3-(oxan-4-yl)pyridine?
The IUPAC name of 2,5-difluoro-3-(oxan-4-yl)pyridine (CID 58548523) is 2,5-difluoro-3-(oxan-4-yl)pyridine.
What is the SMILES notation for 2,5-difluoro-3-(oxan-4-yl)pyridine?
The canonical SMILES for 2,5-difluoro-3-(oxan-4-yl)pyridine is Fc1cnc(F)c(C2CCOCC2)c1.
What is the InChIKey of 2,5-difluoro-3-(oxan-4-yl)pyridine?
The InChIKey is REUJKMFCCZXXER-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11F2NO/c11-8-5-9(10(12)13-6-8)7-1-3-14-4-2-7/h5-7H,1-4H2.
What are the key properties of 2,5-difluoro-3-(oxan-4-yl)pyridine?
2,5-difluoro-3-(oxan-4-yl)pyridine has a molecular weight of 199.20 g/mol, XLogP of 2.25, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-difluoro-3-(oxan-4-yl)pyridine is sourced from PubChem (CID 58548523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).