3-fluoro-N-[5-[2-methyl-5-(1,3,4-oxadiazol-2-yl)phenyl]thiophen-2-yl]pyridine-4-carboxamide

C19H13FN4O2S — CID 11574448

About 3-fluoro-N-[5-[2-methyl-5-(1,3,4-oxadiazol-2-yl)phenyl]thiophen-2-yl]pyridine-4-carboxamide

3-fluoro-N-[5-[2-methyl-5-(1,3,4-oxadiazol-2-yl)phenyl]thiophen-2-yl]pyridine-4-carboxamide (PubChem CID 11574448) has the molecular formula C19H13FN4O2S and a molecular weight of 380.40 g/mol. Its IUPAC name is 3-fluoro-N-[5-[2-methyl-5-(1,3,4-oxadiazol-2-yl)phenyl]thiophen-2-yl]pyridine-4-carboxamide.

Molecular Properties

• Compound Name: 3-fluoro-N-[5-[2-methyl-5-(1,3,4-oxadiazol-2-yl)phenyl]thiophen-2-yl]pyridine-4-carboxamide
• PubChem CID: 11574448
• Molecular Formula: C19H13FN4O2S
• Molecular Weight: 380.40 g/mol
• Exact Mass: 380.07
• IUPAC Name: 3-fluoro-N-[5-[2-methyl-5-(1,3,4-oxadiazol-2-yl)phenyl]thiophen-2-yl]pyridine-4-carboxamide
• SMILES: Cc1ccc(-c2nnco2)cc1-c1ccc(NC(=O)c2ccncc2F)s1
• InChI: InChI=1S/C19H13FN4O2S/c1-11-2-3-12(19-24-22-10-26-19)8-14(11)16-4-5-17(27-16)23-18(25)13-6-7-21-9-15(13)20/h2-10H,1H3,(H,23,25)
• InChIKey: PTEJNWGOBSKDCI-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 3-fluoro-N-[5-[2-methyl-5-(1,3,4-oxadiazol-2-yl)phenyl]thiophen-2-yl]pyridine-4-carboxamide?

The IUPAC name of 3-fluoro-N-[5-[2-methyl-5-(1,3,4-oxadiazol-2-yl)phenyl]thiophen-2-yl]pyridine-4-carboxamide (CID 11574448) is 3-fluoro-N-[5-[2-methyl-5-(1,3,4-oxadiazol-2-yl)phenyl]thiophen-2-yl]pyridine-4-carboxamide.

What is the SMILES notation for 3-fluoro-N-[5-[2-methyl-5-(1,3,4-oxadiazol-2-yl)phenyl]thiophen-2-yl]pyridine-4-carboxamide?

The canonical SMILES for 3-fluoro-N-[5-[2-methyl-5-(1,3,4-oxadiazol-2-yl)phenyl]thiophen-2-yl]pyridine-4-carboxamide is Cc1ccc(-c2nnco2)cc1-c1ccc(NC(=O)c2ccncc2F)s1.

What is the InChIKey of 3-fluoro-N-[5-[2-methyl-5-(1,3,4-oxadiazol-2-yl)phenyl]thiophen-2-yl]pyridine-4-carboxamide?

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

What are the key properties of 3-fluoro-N-[5-[2-methyl-5-(1,3,4-oxadiazol-2-yl)phenyl]thiophen-2-yl]pyridine-4-carboxamide?

3-fluoro-N-[5-[2-methyl-5-(1,3,4-oxadiazol-2-yl)phenyl]thiophen-2-yl]pyridine-4-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 3-fluoro-N-[5-[2-methyl-5-(1,3,4-oxadiazol-2-yl)phenyl]thiophen-2-yl]pyridine-4-carboxamide is sourced from PubChem (CID 11574448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).