4,6-dimethyl-N-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]pyridine-2-carboxamide

C18H18N4O4S — CID 19224436

About 4,6-dimethyl-N-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]pyridine-2-carboxamide

4,6-dimethyl-N-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]pyridine-2-carboxamide (PubChem CID 19224436) has the molecular formula C18H18N4O4S and a molecular weight of 386.43 g/mol. Its IUPAC name is 4,6-dimethyl-N-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]pyridine-2-carboxamide.

Molecular Properties

• Compound Name: 4,6-dimethyl-N-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]pyridine-2-carboxamide
• PubChem CID: 19224436
• Molecular Formula: C18H18N4O4S
• Molecular Weight: 386.43 g/mol
• Exact Mass: 386.10
• IUPAC Name: 4,6-dimethyl-N-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]pyridine-2-carboxamide
• SMILES: Cc1cc(C)nc(C(=O)Nc2ccc(S(=O)(=O)Nc3cc(C)on3)cc2)c1
• InChI: InChI=1S/C18H18N4O4S/c1-11-8-12(2)19-16(9-11)18(23)20-14-4-6-15(7-5-14)27(24,25)22-17-10-13(3)26-21-17/h4-10H,1-3H3,(H,20,23)(H,21,22)
• InChIKey: XJSCVHIFKGRPLC-UHFFFAOYSA-N
• XLogP: 3.05
• TPSA: 114.19 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 6
• Rotatable Bonds: 5
• Heavy Atoms: 27
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	386.43
LogP ≤ 5	3.05
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 4,6-dimethyl-N-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]pyridine-2-carboxamide?

The IUPAC name of 4,6-dimethyl-N-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]pyridine-2-carboxamide (CID 19224436) is 4,6-dimethyl-N-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]pyridine-2-carboxamide.

What is the SMILES notation for 4,6-dimethyl-N-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]pyridine-2-carboxamide?

The canonical SMILES for 4,6-dimethyl-N-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]pyridine-2-carboxamide is Cc1cc(C)nc(C(=O)Nc2ccc(S(=O)(=O)Nc3cc(C)on3)cc2)c1.

What is the InChIKey of 4,6-dimethyl-N-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]pyridine-2-carboxamide?

The InChIKey is XJSCVHIFKGRPLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N4O4S/c1-11-8-12(2)19-16(9-11)18(23)20-14-4-6-15(7-5-14)27(24,25)22-17-10-13(3)26-21-17/h4-10H,1-3H3,(H,20,23)(H,21,22).

What are the key properties of 4,6-dimethyl-N-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]pyridine-2-carboxamide?

4,6-dimethyl-N-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]pyridine-2-carboxamide has a molecular weight of 386.43 g/mol, XLogP of 3.05, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 4,6-dimethyl-N-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]pyridine-2-carboxamide is sourced from PubChem (CID 19224436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).