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

C18H11F2N5O2S — CID 24876236

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

3,5-difluoro-N-[5-[3-methyl-5-(1,3,4-oxadiazol-2-yl)thiophen-2-yl]-2-pyridinyl]pyridine-4-carboxamide (PubChem CID 24876236) has the molecular formula C18H11F2N5O2S and a molecular weight of 399.38 g/mol. Its IUPAC name is 3,5-difluoro-N-[5-[3-methyl-5-(1,3,4-oxadiazol-2-yl)thiophen-2-yl]-2-pyridinyl]pyridine-4-carboxamide.

Molecular Properties

• Compound Name: 3,5-difluoro-N-[5-[3-methyl-5-(1,3,4-oxadiazol-2-yl)thiophen-2-yl]-2-pyridinyl]pyridine-4-carboxamide
• PubChem CID: 24876236
• Molecular Formula: C18H11F2N5O2S
• Molecular Weight: 399.38 g/mol
• Exact Mass: 399.06
• IUPAC Name: 3,5-difluoro-N-[5-[3-methyl-5-(1,3,4-oxadiazol-2-yl)thiophen-2-yl]-2-pyridinyl]pyridine-4-carboxamide
• SMILES: Cc1cc(-c2nnco2)sc1-c1ccc(NC(=O)c2c(F)cncc2F)nc1
• InChI: InChI=1S/C18H11F2N5O2S/c1-9-4-13(18-25-23-8-27-18)28-16(9)10-2-3-14(22-5-10)24-17(26)15-11(19)6-21-7-12(15)20/h2-8H,1H3,(H,22,24,26)
• InChIKey: GTKIZSBVRZRZLP-UHFFFAOYSA-N
• XLogP: 4.09
• TPSA: 93.80 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 7
• Rotatable Bonds: 4
• Heavy Atoms: 28
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	399.38
LogP ≤ 5	4.09
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of 3,5-difluoro-N-[5-[3-methyl-5-(1,3,4-oxadiazol-2-yl)thiophen-2-yl]-2-pyridinyl]pyridine-4-carboxamide?

The IUPAC name of 3,5-difluoro-N-[5-[3-methyl-5-(1,3,4-oxadiazol-2-yl)thiophen-2-yl]-2-pyridinyl]pyridine-4-carboxamide (CID 24876236) is 3,5-difluoro-N-[5-[3-methyl-5-(1,3,4-oxadiazol-2-yl)thiophen-2-yl]-2-pyridinyl]pyridine-4-carboxamide.

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

The canonical SMILES for 3,5-difluoro-N-[5-[3-methyl-5-(1,3,4-oxadiazol-2-yl)thiophen-2-yl]-2-pyridinyl]pyridine-4-carboxamide is Cc1cc(-c2nnco2)sc1-c1ccc(NC(=O)c2c(F)cncc2F)nc1.

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

The InChIKey is GTKIZSBVRZRZLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H11F2N5O2S/c1-9-4-13(18-25-23-8-27-18)28-16(9)10-2-3-14(22-5-10)24-17(26)15-11(19)6-21-7-12(15)20/h2-8H,1H3,(H,22,24,26).

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

3,5-difluoro-N-[5-[3-methyl-5-(1,3,4-oxadiazol-2-yl)thiophen-2-yl]-2-pyridinyl]pyridine-4-carboxamide has a molecular weight of 399.38 g/mol, XLogP of 4.09, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for 3,5-difluoro-N-[5-[3-methyl-5-(1,3,4-oxadiazol-2-yl)thiophen-2-yl]-2-pyridinyl]pyridine-4-carboxamide is sourced from PubChem (CID 24876236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).