4-methoxy-1-methyl-6-oxo-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide

C16H14N4O3S — CID 91813993

About 4-methoxy-1-methyl-6-oxo-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide

4-methoxy-1-methyl-6-oxo-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide (PubChem CID 91813993) has the molecular formula C16H14N4O3S and a molecular weight of 342.38 g/mol. Its IUPAC name is 4-methoxy-1-methyl-6-oxo-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide.

Molecular Properties

• Compound Name: 4-methoxy-1-methyl-6-oxo-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide
• PubChem CID: 91813993
• Molecular Formula: C16H14N4O3S
• Molecular Weight: 342.38 g/mol
• Exact Mass: 342.08
• IUPAC Name: 4-methoxy-1-methyl-6-oxo-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide
• SMILES: COc1cc(=O)n(C)cc1C(=O)Nc1nc(-c2ccccn2)cs1
• InChI: InChI=1S/C16H14N4O3S/c1-20-8-10(13(23-2)7-14(20)21)15(22)19-16-18-12(9-24-16)11-5-3-4-6-17-11/h3-9H,1-2H3,(H,18,19,22)
• InChIKey: LZIRQCSZBFODQY-UHFFFAOYSA-N
• XLogP: 2.16
• TPSA: 86.11 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 7
• Rotatable Bonds: 4
• Heavy Atoms: 24
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	342.38
LogP ≤ 5	2.16
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-1-methyl-6-oxo-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide?

The IUPAC name of 4-methoxy-1-methyl-6-oxo-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide (CID 91813993) is 4-methoxy-1-methyl-6-oxo-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide.

What is the SMILES notation for 4-methoxy-1-methyl-6-oxo-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide?

The canonical SMILES for 4-methoxy-1-methyl-6-oxo-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide is COc1cc(=O)n(C)cc1C(=O)Nc1nc(-c2ccccn2)cs1.

What is the InChIKey of 4-methoxy-1-methyl-6-oxo-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide?

The InChIKey is LZIRQCSZBFODQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N4O3S/c1-20-8-10(13(23-2)7-14(20)21)15(22)19-16-18-12(9-24-16)11-5-3-4-6-17-11/h3-9H,1-2H3,(H,18,19,22).

What are the key properties of 4-methoxy-1-methyl-6-oxo-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide?

4-methoxy-1-methyl-6-oxo-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide has a molecular weight of 342.38 g/mol, XLogP of 2.16, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for 4-methoxy-1-methyl-6-oxo-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide is sourced from PubChem (CID 91813993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).