4-(4-fluorophenyl)-2-methyl-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-1,3-oxazole-5-carboxamide

C19H13FN4O2S — CID 176859167

About 4-(4-fluorophenyl)-2-methyl-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-1,3-oxazole-5-carboxamide

4-(4-fluorophenyl)-2-methyl-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-1,3-oxazole-5-carboxamide (PubChem CID 176859167) has the molecular formula C19H13FN4O2S and a molecular weight of 380.40 g/mol. Its IUPAC name is 4-(4-fluorophenyl)-2-methyl-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-1,3-oxazole-5-carboxamide.

Molecular Properties

• Compound Name: 4-(4-fluorophenyl)-2-methyl-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-1,3-oxazole-5-carboxamide
• PubChem CID: 176859167
• Molecular Formula: C19H13FN4O2S
• Molecular Weight: 380.40 g/mol
• Exact Mass: 380.07
• IUPAC Name: 4-(4-fluorophenyl)-2-methyl-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-1,3-oxazole-5-carboxamide
• SMILES: Cc1nc(-c2ccc(F)cc2)c(C(=O)Nc2nc(-c3ccccn3)cs2)o1
• InChI: InChI=1S/C19H13FN4O2S/c1-11-22-16(12-5-7-13(20)8-6-12)17(26-11)18(25)24-19-23-15(10-27-19)14-4-2-3-9-21-14/h2-10H,1H3,(H,23,24,25)
• InChIKey: UXIZDILJSMALJZ-UHFFFAOYSA-N
• XLogP: 4.56
• TPSA: 80.91 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 6
• Rotatable Bonds: 4
• Heavy Atoms: 27
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	380.40
LogP ≤ 5	4.56
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 4-(4-fluorophenyl)-2-methyl-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-1,3-oxazole-5-carboxamide?

The IUPAC name of 4-(4-fluorophenyl)-2-methyl-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-1,3-oxazole-5-carboxamide (CID 176859167) is 4-(4-fluorophenyl)-2-methyl-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-1,3-oxazole-5-carboxamide.

What is the SMILES notation for 4-(4-fluorophenyl)-2-methyl-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-1,3-oxazole-5-carboxamide?

The canonical SMILES for 4-(4-fluorophenyl)-2-methyl-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-1,3-oxazole-5-carboxamide is Cc1nc(-c2ccc(F)cc2)c(C(=O)Nc2nc(-c3ccccn3)cs2)o1.

What is the InChIKey of 4-(4-fluorophenyl)-2-methyl-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-1,3-oxazole-5-carboxamide?

The InChIKey is UXIZDILJSMALJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13FN4O2S/c1-11-22-16(12-5-7-13(20)8-6-12)17(26-11)18(25)24-19-23-15(10-27-19)14-4-2-3-9-21-14/h2-10H,1H3,(H,23,24,25).

What are the key properties of 4-(4-fluorophenyl)-2-methyl-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-1,3-oxazole-5-carboxamide?

4-(4-fluorophenyl)-2-methyl-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-1,3-oxazole-5-carboxamide has a molecular weight of 380.40 g/mol, XLogP of 4.56, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 4-(4-fluorophenyl)-2-methyl-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-1,3-oxazole-5-carboxamide is sourced from PubChem (CID 176859167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).