2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(6-ethoxy-1,3-benzothiazol-2-yl)acetamide

C20H24N4O5S2 — CID 26251715

About 2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(6-ethoxy-1,3-benzothiazol-2-yl)acetamide

2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(6-ethoxy-1,3-benzothiazol-2-yl)acetamide (PubChem CID 26251715) has the molecular formula C20H24N4O5S2 and a molecular weight of 464.57 g/mol. Its IUPAC name is 2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(6-ethoxy-1,3-benzothiazol-2-yl)acetamide.

Molecular Properties

• Compound Name: 2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(6-ethoxy-1,3-benzothiazol-2-yl)acetamide
• PubChem CID: 26251715
• Molecular Formula: C20H24N4O5S2
• Molecular Weight: 464.57 g/mol
• Exact Mass: 464.12
• IUPAC Name: 2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(6-ethoxy-1,3-benzothiazol-2-yl)acetamide
• SMILES: CCOc1ccc2nc(NC(=O)Cn3cc(S(=O)(=O)N(CC)CC)ccc3=O)sc2c1
• InChI: InChI=1S/C20H24N4O5S2/c1-4-24(5-2)31(27,28)15-8-10-19(26)23(12-15)13-18(25)22-20-21-16-9-7-14(29-6-3)11-17(16)30-20/h7-12H,4-6,13H2,1-3H3,(H,21,22,25)
• InChIKey: JMVTYNNCQDVELZ-UHFFFAOYSA-N
• XLogP: 2.53
• TPSA: 110.60 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 8
• Rotatable Bonds: 9
• Heavy Atoms: 31
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	464.57
LogP ≤ 5	2.53
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	8

Frequently Asked Questions

What is the IUPAC name of 2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(6-ethoxy-1,3-benzothiazol-2-yl)acetamide?

The IUPAC name of 2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(6-ethoxy-1,3-benzothiazol-2-yl)acetamide (CID 26251715) is 2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(6-ethoxy-1,3-benzothiazol-2-yl)acetamide.

What is the SMILES notation for 2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(6-ethoxy-1,3-benzothiazol-2-yl)acetamide?

The canonical SMILES for 2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(6-ethoxy-1,3-benzothiazol-2-yl)acetamide is CCOc1ccc2nc(NC(=O)Cn3cc(S(=O)(=O)N(CC)CC)ccc3=O)sc2c1.

What is the InChIKey of 2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(6-ethoxy-1,3-benzothiazol-2-yl)acetamide?

The InChIKey is JMVTYNNCQDVELZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N4O5S2/c1-4-24(5-2)31(27,28)15-8-10-19(26)23(12-15)13-18(25)22-20-21-16-9-7-14(29-6-3)11-17(16)30-20/h7-12H,4-6,13H2,1-3H3,(H,21,22,25).

What are the key properties of 2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(6-ethoxy-1,3-benzothiazol-2-yl)acetamide?

2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(6-ethoxy-1,3-benzothiazol-2-yl)acetamide has a molecular weight of 464.57 g/mol, XLogP of 2.53, 9 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(6-ethoxy-1,3-benzothiazol-2-yl)acetamide is sourced from PubChem (CID 26251715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).