2-methyl-N-(4-methyl-1,3-benzothiazol-2-yl)-N-(pyridin-3-ylmethyl)imidazo[1,2-a]pyridine-3-carboxamide

C23H19N5OS — CID 43967418

About 2-methyl-N-(4-methyl-1,3-benzothiazol-2-yl)-N-(pyridin-3-ylmethyl)imidazo[1,2-a]pyridine-3-carboxamide

2-methyl-N-(4-methyl-1,3-benzothiazol-2-yl)-N-(pyridin-3-ylmethyl)imidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 43967418) has the molecular formula C23H19N5OS and a molecular weight of 413.51 g/mol. Its IUPAC name is 2-methyl-N-(4-methyl-1,3-benzothiazol-2-yl)-N-(pyridin-3-ylmethyl)imidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

• Compound Name: 2-methyl-N-(4-methyl-1,3-benzothiazol-2-yl)-N-(pyridin-3-ylmethyl)imidazo[1,2-a]pyridine-3-carboxamide
• PubChem CID: 43967418
• Molecular Formula: C23H19N5OS
• Molecular Weight: 413.51 g/mol
• Exact Mass: 413.13
• IUPAC Name: 2-methyl-N-(4-methyl-1,3-benzothiazol-2-yl)-N-(pyridin-3-ylmethyl)imidazo[1,2-a]pyridine-3-carboxamide
• SMILES: Cc1nc2ccccn2c1C(=O)N(Cc1cccnc1)c1nc2c(C)cccc2s1
• InChI: InChI=1S/C23H19N5OS/c1-15-7-5-9-18-20(15)26-23(30-18)28(14-17-8-6-11-24-13-17)22(29)21-16(2)25-19-10-3-4-12-27(19)21/h3-13H,14H2,1-2H3
• InChIKey: ZNFCUVOEHONZGV-UHFFFAOYSA-N
• XLogP: 4.80
• TPSA: 63.39 Ų
• H-Bond Acceptors: 6
• Rotatable Bonds: 4
• Heavy Atoms: 30
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	413.51
LogP ≤ 5	4.80
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(4-methyl-1,3-benzothiazol-2-yl)-N-(pyridin-3-ylmethyl)imidazo[1,2-a]pyridine-3-carboxamide?

The IUPAC name of 2-methyl-N-(4-methyl-1,3-benzothiazol-2-yl)-N-(pyridin-3-ylmethyl)imidazo[1,2-a]pyridine-3-carboxamide (CID 43967418) is 2-methyl-N-(4-methyl-1,3-benzothiazol-2-yl)-N-(pyridin-3-ylmethyl)imidazo[1,2-a]pyridine-3-carboxamide.

What is the SMILES notation for 2-methyl-N-(4-methyl-1,3-benzothiazol-2-yl)-N-(pyridin-3-ylmethyl)imidazo[1,2-a]pyridine-3-carboxamide?

The canonical SMILES for 2-methyl-N-(4-methyl-1,3-benzothiazol-2-yl)-N-(pyridin-3-ylmethyl)imidazo[1,2-a]pyridine-3-carboxamide is Cc1nc2ccccn2c1C(=O)N(Cc1cccnc1)c1nc2c(C)cccc2s1.

What is the InChIKey of 2-methyl-N-(4-methyl-1,3-benzothiazol-2-yl)-N-(pyridin-3-ylmethyl)imidazo[1,2-a]pyridine-3-carboxamide?

The InChIKey is ZNFCUVOEHONZGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19N5OS/c1-15-7-5-9-18-20(15)26-23(30-18)28(14-17-8-6-11-24-13-17)22(29)21-16(2)25-19-10-3-4-12-27(19)21/h3-13H,14H2,1-2H3.

What are the key properties of 2-methyl-N-(4-methyl-1,3-benzothiazol-2-yl)-N-(pyridin-3-ylmethyl)imidazo[1,2-a]pyridine-3-carboxamide?

2-methyl-N-(4-methyl-1,3-benzothiazol-2-yl)-N-(pyridin-3-ylmethyl)imidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 413.51 g/mol, XLogP of 4.80, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 2-methyl-N-(4-methyl-1,3-benzothiazol-2-yl)-N-(pyridin-3-ylmethyl)imidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 43967418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).