3-bromo-5-chloro-6-fluoropyrazolo[1,5-a]pyridine

C7H3BrClFN2 — CID 130066078

IUPAC3-bromo-5-chloro-6-fluoropyrazolo[1,5-a]pyridine
SMILESFc1cn2ncc(Br)c2cc1Cl
InChIInChI=1S/C7H3BrClFN2/c8-4-2-11-12-3-6(10)5(9)1-7(4)12/h1-3H
InChIKeyAUTCJJQWONMNAL-UHFFFAOYSA-N
MW249.47 g/mol
LogP2.89
Rot. Bonds

About 3-bromo-5-chloro-6-fluoropyrazolo[1,5-a]pyridine

3-bromo-5-chloro-6-fluoropyrazolo[1,5-a]pyridine (PubChem CID 130066078) has the molecular formula C7H3BrClFN2 and a molecular weight of 249.47 g/mol. Its IUPAC name is 3-bromo-5-chloro-6-fluoropyrazolo[1,5-a]pyridine.

Molecular Properties

Compound Name3-bromo-5-chloro-6-fluoropyrazolo[1,5-a]pyridine
PubChem CID130066078
Molecular FormulaC7H3BrClFN2
Molecular Weight249.47 g/mol
Exact Mass247.92
IUPAC Name3-bromo-5-chloro-6-fluoropyrazolo[1,5-a]pyridine
SMILESFc1cn2ncc(Br)c2cc1Cl
InChIInChI=1S/C7H3BrClFN2/c8-4-2-11-12-3-6(10)5(9)1-7(4)12/h1-3H
InChIKeyAUTCJJQWONMNAL-UHFFFAOYSA-N
XLogP2.89
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.47
LogP ≤ 52.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-bromo-5-chloro-6-fluoropyrazolo[1,5-a]pyridine?
The IUPAC name of 3-bromo-5-chloro-6-fluoropyrazolo[1,5-a]pyridine (CID 130066078) is 3-bromo-5-chloro-6-fluoropyrazolo[1,5-a]pyridine.
What is the SMILES notation for 3-bromo-5-chloro-6-fluoropyrazolo[1,5-a]pyridine?
The canonical SMILES for 3-bromo-5-chloro-6-fluoropyrazolo[1,5-a]pyridine is Fc1cn2ncc(Br)c2cc1Cl.
What is the InChIKey of 3-bromo-5-chloro-6-fluoropyrazolo[1,5-a]pyridine?
The InChIKey is AUTCJJQWONMNAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H3BrClFN2/c8-4-2-11-12-3-6(10)5(9)1-7(4)12/h1-3H.
What are the key properties of 3-bromo-5-chloro-6-fluoropyrazolo[1,5-a]pyridine?
3-bromo-5-chloro-6-fluoropyrazolo[1,5-a]pyridine has a molecular weight of 249.47 g/mol, XLogP of 2.89, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-5-chloro-6-fluoropyrazolo[1,5-a]pyridine is sourced from PubChem (CID 130066078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).