5-(2,6-diethylanilino)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-3-carboxamide

C20H22N4O2 — CID 109243974

About 5-(2,6-diethylanilino)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-3-carboxamide

5-(2,6-diethylanilino)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-3-carboxamide (PubChem CID 109243974) has the molecular formula C20H22N4O2 and a molecular weight of 350.42 g/mol. Its IUPAC name is 5-(2,6-diethylanilino)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-3-carboxamide.

Molecular Properties

• Compound Name: 5-(2,6-diethylanilino)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-3-carboxamide
• PubChem CID: 109243974
• Molecular Formula: C20H22N4O2
• Molecular Weight: 350.42 g/mol
• Exact Mass: 350.17
• IUPAC Name: 5-(2,6-diethylanilino)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-3-carboxamide
• SMILES: CCc1cccc(CC)c1Nc1cncc(C(=O)Nc2cc(C)on2)c1
• InChI: InChI=1S/C20H22N4O2/c1-4-14-7-6-8-15(5-2)19(14)22-17-10-16(11-21-12-17)20(25)23-18-9-13(3)26-24-18/h6-12,22H,4-5H2,1-3H3,(H,23,24,25)
• InChIKey: AIJVOGSHVMNJBB-UHFFFAOYSA-N
• XLogP: 4.50
• TPSA: 80.05 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 5
• Rotatable Bonds: 6
• Heavy Atoms: 26
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	350.42
LogP ≤ 5	4.50
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of 5-(2,6-diethylanilino)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-3-carboxamide?

The IUPAC name of 5-(2,6-diethylanilino)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-3-carboxamide (CID 109243974) is 5-(2,6-diethylanilino)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-3-carboxamide.

What is the SMILES notation for 5-(2,6-diethylanilino)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-3-carboxamide?

The canonical SMILES for 5-(2,6-diethylanilino)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-3-carboxamide is CCc1cccc(CC)c1Nc1cncc(C(=O)Nc2cc(C)on2)c1.

What is the InChIKey of 5-(2,6-diethylanilino)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-3-carboxamide?

The InChIKey is AIJVOGSHVMNJBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N4O2/c1-4-14-7-6-8-15(5-2)19(14)22-17-10-16(11-21-12-17)20(25)23-18-9-13(3)26-24-18/h6-12,22H,4-5H2,1-3H3,(H,23,24,25).

What are the key properties of 5-(2,6-diethylanilino)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-3-carboxamide?

5-(2,6-diethylanilino)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-3-carboxamide has a molecular weight of 350.42 g/mol, XLogP of 4.50, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 5-(2,6-diethylanilino)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-3-carboxamide is sourced from PubChem (CID 109243974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).