5-(2-ethylpyrazol-3-yl)-4-methoxypyrimidine

C₁₀H₁₂N₄O — CID 167813363

About 5-(2-ethylpyrazol-3-yl)-4-methoxypyrimidine

5-(2-ethylpyrazol-3-yl)-4-methoxypyrimidine (PubChem CID 167813363) has the molecular formula C₁₀H₁₂N₄O and a molecular weight of 204.23 g/mol. Its IUPAC name is 5-(2-ethylpyrazol-3-yl)-4-methoxypyrimidine.

Molecular Properties

• Compound Name: 5-(2-ethylpyrazol-3-yl)-4-methoxypyrimidine
• PubChem CID: 167813363
• Molecular Formula: C₁₀H₁₂N₄O
• Molecular Weight: 204.23 g/mol
• Exact Mass: 204.10
• IUPAC Name: 5-(2-ethylpyrazol-3-yl)-4-methoxypyrimidine
• SMILES: CCn1nccc1-c1cncnc1OC
• InChI: InChI=1S/C10H12N4O/c1-3-14-9(4-5-13-14)8-6-11-7-12-10(8)15-2/h4-7H,3H2,1-2H3
• InChIKey: VZEBPXFMGFRBFA-UHFFFAOYSA-N
• XLogP: 1.37
• TPSA: 52.83 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 3
• Heavy Atoms: 15
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	204.23
LogP ≤ 5	1.37
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of 5-(2-ethylpyrazol-3-yl)-4-methoxypyrimidine?

The IUPAC name of 5-(2-ethylpyrazol-3-yl)-4-methoxypyrimidine (CID 167813363) is 5-(2-ethylpyrazol-3-yl)-4-methoxypyrimidine.

What is the SMILES notation for 5-(2-ethylpyrazol-3-yl)-4-methoxypyrimidine?

The canonical SMILES for 5-(2-ethylpyrazol-3-yl)-4-methoxypyrimidine is CCn1nccc1-c1cncnc1OC.

What is the InChIKey of 5-(2-ethylpyrazol-3-yl)-4-methoxypyrimidine?

The InChIKey is VZEBPXFMGFRBFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4O/c1-3-14-9(4-5-13-14)8-6-11-7-12-10(8)15-2/h4-7H,3H2,1-2H3.

What are the key properties of 5-(2-ethylpyrazol-3-yl)-4-methoxypyrimidine?

5-(2-ethylpyrazol-3-yl)-4-methoxypyrimidine has a molecular weight of 204.23 g/mol, XLogP of 1.37, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 5-(2-ethylpyrazol-3-yl)-4-methoxypyrimidine is sourced from PubChem (CID 167813363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 167813363 — identifiers, structure, computed properties (public domain)

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