Ethyl 5-amino-4-bromopyrazolo[1,5-a]pyridine-3-carboxylate

C₁₀H₁₀BrN₃O₂ — CID 146160563

About Ethyl 5-amino-4-bromopyrazolo[1,5-a]pyridine-3-carboxylate

Ethyl 5-amino-4-bromopyrazolo[1,5-a]pyridine-3-carboxylate (PubChem CID 146160563) has the molecular formula C₁₀H₁₀BrN₃O₂ and a molecular weight of 284.11 g/mol. Its IUPAC name is ethyl 5-amino-4-bromopyrazolo[1,5-a]pyridine-3-carboxylate.

Molecular Properties

• Compound Name: Ethyl 5-amino-4-bromopyrazolo[1,5-a]pyridine-3-carboxylate
• PubChem CID: 146160563
• Molecular Formula: C₁₀H₁₀BrN₃O₂
• Molecular Weight: 284.11 g/mol
• Exact Mass: 283.00
• IUPAC Name: ethyl 5-amino-4-bromopyrazolo[1,5-a]pyridine-3-carboxylate
• SMILES: CCOC(=O)c1cnn2ccc(N)c(Br)c12
• InChI: InChI=1S/C10H10BrN3O2/c1-2-16-10(15)6-5-13-14-4-3-7(12)8(11)9(6)14/h3-5H,2,12H2,1H3
• InChIKey: ODZZSWBMUJWOER-UHFFFAOYSA-N
• XLogP: 1.86
• TPSA: 69.62 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 5
• Rotatable Bonds: 2
• Heavy Atoms: 16
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	284.11
LogP ≤ 5	1.86
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of Ethyl 5-amino-4-bromopyrazolo[1,5-a]pyridine-3-carboxylate?

The IUPAC name of Ethyl 5-amino-4-bromopyrazolo[1,5-a]pyridine-3-carboxylate (CID 146160563) is ethyl 5-amino-4-bromopyrazolo[1,5-a]pyridine-3-carboxylate.

What is the SMILES notation for Ethyl 5-amino-4-bromopyrazolo[1,5-a]pyridine-3-carboxylate?

The canonical SMILES for Ethyl 5-amino-4-bromopyrazolo[1,5-a]pyridine-3-carboxylate is CCOC(=O)c1cnn2ccc(N)c(Br)c12.

What is the InChIKey of Ethyl 5-amino-4-bromopyrazolo[1,5-a]pyridine-3-carboxylate?

The InChIKey is ODZZSWBMUJWOER-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10BrN3O2/c1-2-16-10(15)6-5-13-14-4-3-7(12)8(11)9(6)14/h3-5H,2,12H2,1H3.

What are the key properties of Ethyl 5-amino-4-bromopyrazolo[1,5-a]pyridine-3-carboxylate?

Ethyl 5-amino-4-bromopyrazolo[1,5-a]pyridine-3-carboxylate has a molecular weight of 284.11 g/mol, XLogP of 1.86, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for Ethyl 5-amino-4-bromopyrazolo[1,5-a]pyridine-3-carboxylate is sourced from PubChem (CID 146160563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 146160563 — identifiers, structure, computed properties (public domain)

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