2-(2-methyl-1,3-thiazol-5-yl)-N-[[1-(6-pyridin-4-ylpyridazin-3-yl)azetidin-3-yl]methyl]acetamide

C19H20N6OS — CID 126919980

About 2-(2-methyl-1,3-thiazol-5-yl)-N-[[1-(6-pyridin-4-ylpyridazin-3-yl)azetidin-3-yl]methyl]acetamide

2-(2-methyl-1,3-thiazol-5-yl)-N-[[1-(6-pyridin-4-ylpyridazin-3-yl)azetidin-3-yl]methyl]acetamide (PubChem CID 126919980) has the molecular formula C19H20N6OS and a molecular weight of 380.48 g/mol. Its IUPAC name is 2-(2-methyl-1,3-thiazol-5-yl)-N-[[1-(6-pyridin-4-ylpyridazin-3-yl)azetidin-3-yl]methyl]acetamide.

Molecular Properties

• Compound Name: 2-(2-methyl-1,3-thiazol-5-yl)-N-[[1-(6-pyridin-4-ylpyridazin-3-yl)azetidin-3-yl]methyl]acetamide
• PubChem CID: 126919980
• Molecular Formula: C19H20N6OS
• Molecular Weight: 380.48 g/mol
• Exact Mass: 380.14
• IUPAC Name: 2-(2-methyl-1,3-thiazol-5-yl)-N-[[1-(6-pyridin-4-ylpyridazin-3-yl)azetidin-3-yl]methyl]acetamide
• SMILES: Cc1ncc(CC(=O)NCC2CN(c3ccc(-c4ccncc4)nn3)C2)s1
• InChI: InChI=1S/C19H20N6OS/c1-13-21-10-16(27-13)8-19(26)22-9-14-11-25(12-14)18-3-2-17(23-24-18)15-4-6-20-7-5-15/h2-7,10,14H,8-9,11-12H2,1H3,(H,22,26)
• InChIKey: SXLJSNDDWGECPZ-UHFFFAOYSA-N
• XLogP: 2.10
• TPSA: 83.90 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 7
• Rotatable Bonds: 6
• Heavy Atoms: 27
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	380.48
LogP ≤ 5	2.10
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of 2-(2-methyl-1,3-thiazol-5-yl)-N-[[1-(6-pyridin-4-ylpyridazin-3-yl)azetidin-3-yl]methyl]acetamide?

The IUPAC name of 2-(2-methyl-1,3-thiazol-5-yl)-N-[[1-(6-pyridin-4-ylpyridazin-3-yl)azetidin-3-yl]methyl]acetamide (CID 126919980) is 2-(2-methyl-1,3-thiazol-5-yl)-N-[[1-(6-pyridin-4-ylpyridazin-3-yl)azetidin-3-yl]methyl]acetamide.

What is the SMILES notation for 2-(2-methyl-1,3-thiazol-5-yl)-N-[[1-(6-pyridin-4-ylpyridazin-3-yl)azetidin-3-yl]methyl]acetamide?

The canonical SMILES for 2-(2-methyl-1,3-thiazol-5-yl)-N-[[1-(6-pyridin-4-ylpyridazin-3-yl)azetidin-3-yl]methyl]acetamide is Cc1ncc(CC(=O)NCC2CN(c3ccc(-c4ccncc4)nn3)C2)s1.

What is the InChIKey of 2-(2-methyl-1,3-thiazol-5-yl)-N-[[1-(6-pyridin-4-ylpyridazin-3-yl)azetidin-3-yl]methyl]acetamide?

The InChIKey is SXLJSNDDWGECPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N6OS/c1-13-21-10-16(27-13)8-19(26)22-9-14-11-25(12-14)18-3-2-17(23-24-18)15-4-6-20-7-5-15/h2-7,10,14H,8-9,11-12H2,1H3,(H,22,26).

What are the key properties of 2-(2-methyl-1,3-thiazol-5-yl)-N-[[1-(6-pyridin-4-ylpyridazin-3-yl)azetidin-3-yl]methyl]acetamide?

2-(2-methyl-1,3-thiazol-5-yl)-N-[[1-(6-pyridin-4-ylpyridazin-3-yl)azetidin-3-yl]methyl]acetamide has a molecular weight of 380.48 g/mol, XLogP of 2.10, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(2-methyl-1,3-thiazol-5-yl)-N-[[1-(6-pyridin-4-ylpyridazin-3-yl)azetidin-3-yl]methyl]acetamide is sourced from PubChem (CID 126919980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).