5-bromo-2-(4-fluoro-1-methylpyrazol-3-yl)pyridine

C9H7BrFN3 — CID 67294890

IUPAC5-bromo-2-(4-fluoro-1-methylpyrazol-3-yl)pyridine
SMILESCn1cc(F)c(-c2ccc(Br)cn2)n1
InChIInChI=1S/C9H7BrFN3/c1-14-5-7(11)9(13-14)8-3-2-6(10)4-12-8/h2-5H,1H3
InChIKeyFNQCBQREJWJLTF-UHFFFAOYSA-N
MW256.08 g/mol
LogP2.38
Rot. Bonds1

About 5-bromo-2-(4-fluoro-1-methylpyrazol-3-yl)pyridine

5-bromo-2-(4-fluoro-1-methylpyrazol-3-yl)pyridine (PubChem CID 67294890) has the molecular formula C9H7BrFN3 and a molecular weight of 256.08 g/mol. Its IUPAC name is 5-bromo-2-(4-fluoro-1-methylpyrazol-3-yl)pyridine.

Molecular Properties

Compound Name5-bromo-2-(4-fluoro-1-methylpyrazol-3-yl)pyridine
PubChem CID67294890
Molecular FormulaC9H7BrFN3
Molecular Weight256.08 g/mol
Exact Mass254.98
IUPAC Name5-bromo-2-(4-fluoro-1-methylpyrazol-3-yl)pyridine
SMILESCn1cc(F)c(-c2ccc(Br)cn2)n1
InChIInChI=1S/C9H7BrFN3/c1-14-5-7(11)9(13-14)8-3-2-6(10)4-12-8/h2-5H,1H3
InChIKeyFNQCBQREJWJLTF-UHFFFAOYSA-N
XLogP2.38
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.08
LogP ≤ 52.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 5-bromo-2-(4-fluoro-1-methylpyrazol-3-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 5-bromo-2-(4-fluoro-1-methylpyrazol-3-yl)pyridine?
The IUPAC name of 5-bromo-2-(4-fluoro-1-methylpyrazol-3-yl)pyridine (CID 67294890) is 5-bromo-2-(4-fluoro-1-methylpyrazol-3-yl)pyridine.
What is the SMILES notation for 5-bromo-2-(4-fluoro-1-methylpyrazol-3-yl)pyridine?
The canonical SMILES for 5-bromo-2-(4-fluoro-1-methylpyrazol-3-yl)pyridine is Cn1cc(F)c(-c2ccc(Br)cn2)n1.
What is the InChIKey of 5-bromo-2-(4-fluoro-1-methylpyrazol-3-yl)pyridine?
The InChIKey is FNQCBQREJWJLTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7BrFN3/c1-14-5-7(11)9(13-14)8-3-2-6(10)4-12-8/h2-5H,1H3.
What are the key properties of 5-bromo-2-(4-fluoro-1-methylpyrazol-3-yl)pyridine?
5-bromo-2-(4-fluoro-1-methylpyrazol-3-yl)pyridine has a molecular weight of 256.08 g/mol, XLogP of 2.38, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-2-(4-fluoro-1-methylpyrazol-3-yl)pyridine is sourced from PubChem (CID 67294890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).