4-(3,5-diethyl-1H-pyrazol-4-yl)pyridine

C₁₂H₁₅N₃ — CID 102266456

About 4-(3,5-diethyl-1H-pyrazol-4-yl)pyridine

4-(3,5-diethyl-1H-pyrazol-4-yl)pyridine (PubChem CID 102266456) has the molecular formula C₁₂H₁₅N₃ and a molecular weight of 201.27 g/mol. Its IUPAC name is 4-(3,5-diethyl-1H-pyrazol-4-yl)pyridine.

Molecular Properties

• Compound Name: 4-(3,5-diethyl-1H-pyrazol-4-yl)pyridine
• PubChem CID: 102266456
• Molecular Formula: C₁₂H₁₅N₃
• Molecular Weight: 201.27 g/mol
• Exact Mass: 201.13
• IUPAC Name: 4-(3,5-diethyl-1H-pyrazol-4-yl)pyridine
• SMILES: CCc1n[nH]c(CC)c1-c1ccncc1
• InChI: InChI=1S/C12H15N3/c1-3-10-12(11(4-2)15-14-10)9-5-7-13-8-6-9/h5-8H,3-4H2,1-2H3,(H,14,15)
• InChIKey: JQXUYJJGKFFDAO-UHFFFAOYSA-N
• XLogP: 2.60
• TPSA: 41.57 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 2
• Rotatable Bonds: 3
• Heavy Atoms: 15
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	201.27
LogP ≤ 5	2.60
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	2

Frequently Asked Questions

What is the IUPAC name of 4-(3,5-diethyl-1H-pyrazol-4-yl)pyridine?

The IUPAC name of 4-(3,5-diethyl-1H-pyrazol-4-yl)pyridine (CID 102266456) is 4-(3,5-diethyl-1H-pyrazol-4-yl)pyridine.

What is the SMILES notation for 4-(3,5-diethyl-1H-pyrazol-4-yl)pyridine?

The canonical SMILES for 4-(3,5-diethyl-1H-pyrazol-4-yl)pyridine is CCc1n[nH]c(CC)c1-c1ccncc1.

What is the InChIKey of 4-(3,5-diethyl-1H-pyrazol-4-yl)pyridine?

The InChIKey is JQXUYJJGKFFDAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3/c1-3-10-12(11(4-2)15-14-10)9-5-7-13-8-6-9/h5-8H,3-4H2,1-2H3,(H,14,15).

What are the key properties of 4-(3,5-diethyl-1H-pyrazol-4-yl)pyridine?

4-(3,5-diethyl-1H-pyrazol-4-yl)pyridine has a molecular weight of 201.27 g/mol, XLogP of 2.60, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for 4-(3,5-diethyl-1H-pyrazol-4-yl)pyridine is sourced from PubChem (CID 102266456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 102266456 — identifiers, structure, computed properties (public domain)

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