3-bromo-5-methylpyrazolo[1,5-a]pyridine

C8H7BrN2 — CID 83680672

IUPAC3-bromo-5-methylpyrazolo[1,5-a]pyridine
SMILESCc1ccn2ncc(Br)c2c1
InChIInChI=1S/C8H7BrN2/c1-6-2-3-11-8(4-6)7(9)5-10-11/h2-5H,1H3
InChIKeyUEUSPICQNPUFDR-UHFFFAOYSA-N
MW211.06 g/mol
LogP2.41
Rot. Bonds

About 3-bromo-5-methylpyrazolo[1,5-a]pyridine

3-bromo-5-methylpyrazolo[1,5-a]pyridine (PubChem CID 83680672) has the molecular formula C8H7BrN2 and a molecular weight of 211.06 g/mol. Its IUPAC name is 3-bromo-5-methylpyrazolo[1,5-a]pyridine.

Molecular Properties

Compound Name3-bromo-5-methylpyrazolo[1,5-a]pyridine
PubChem CID83680672
Molecular FormulaC8H7BrN2
Molecular Weight211.06 g/mol
Exact Mass209.98
IUPAC Name3-bromo-5-methylpyrazolo[1,5-a]pyridine
SMILESCc1ccn2ncc(Br)c2c1
InChIInChI=1S/C8H7BrN2/c1-6-2-3-11-8(4-6)7(9)5-10-11/h2-5H,1H3
InChIKeyUEUSPICQNPUFDR-UHFFFAOYSA-N
XLogP2.41
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.06
LogP ≤ 52.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-bromo-5-methylpyrazolo[1,5-a]pyridine?
The IUPAC name of 3-bromo-5-methylpyrazolo[1,5-a]pyridine (CID 83680672) is 3-bromo-5-methylpyrazolo[1,5-a]pyridine.
What is the SMILES notation for 3-bromo-5-methylpyrazolo[1,5-a]pyridine?
The canonical SMILES for 3-bromo-5-methylpyrazolo[1,5-a]pyridine is Cc1ccn2ncc(Br)c2c1.
What is the InChIKey of 3-bromo-5-methylpyrazolo[1,5-a]pyridine?
The InChIKey is UEUSPICQNPUFDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7BrN2/c1-6-2-3-11-8(4-6)7(9)5-10-11/h2-5H,1H3.
What are the key properties of 3-bromo-5-methylpyrazolo[1,5-a]pyridine?
3-bromo-5-methylpyrazolo[1,5-a]pyridine has a molecular weight of 211.06 g/mol, XLogP of 2.41, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-5-methylpyrazolo[1,5-a]pyridine is sourced from PubChem (CID 83680672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).