5-chloro-N-[4-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-2-pyridinyl]-2-methoxybenzamide

C19H13ClN4O4 — CID 142440199

About 5-chloro-N-[4-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-2-pyridinyl]-2-methoxybenzamide

5-chloro-N-[4-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-2-pyridinyl]-2-methoxybenzamide (PubChem CID 142440199) has the molecular formula C19H13ClN4O4 and a molecular weight of 396.79 g/mol. Its IUPAC name is 5-chloro-N-[4-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-2-pyridinyl]-2-methoxybenzamide.

Molecular Properties

• Compound Name: 5-chloro-N-[4-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-2-pyridinyl]-2-methoxybenzamide
• PubChem CID: 142440199
• Molecular Formula: C19H13ClN4O4
• Molecular Weight: 396.79 g/mol
• Exact Mass: 396.06
• IUPAC Name: 5-chloro-N-[4-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-2-pyridinyl]-2-methoxybenzamide
• SMILES: COc1ccc(Cl)cc1C(=O)Nc1cc(-c2nnc(-c3ccco3)o2)ccn1
• InChI: InChI=1S/C19H13ClN4O4/c1-26-14-5-4-12(20)10-13(14)17(25)22-16-9-11(6-7-21-16)18-23-24-19(28-18)15-3-2-8-27-15/h2-10H,1H3,(H,21,22,25)
• InChIKey: JJKDTGADKIFSOA-UHFFFAOYSA-N
• XLogP: 4.31
• TPSA: 103.28 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 7
• Rotatable Bonds: 5
• Heavy Atoms: 28
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	396.79
LogP ≤ 5	4.31
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-[4-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-2-pyridinyl]-2-methoxybenzamide?

The IUPAC name of 5-chloro-N-[4-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-2-pyridinyl]-2-methoxybenzamide (CID 142440199) is 5-chloro-N-[4-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-2-pyridinyl]-2-methoxybenzamide.

What is the SMILES notation for 5-chloro-N-[4-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-2-pyridinyl]-2-methoxybenzamide?

The canonical SMILES for 5-chloro-N-[4-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-2-pyridinyl]-2-methoxybenzamide is COc1ccc(Cl)cc1C(=O)Nc1cc(-c2nnc(-c3ccco3)o2)ccn1.

What is the InChIKey of 5-chloro-N-[4-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-2-pyridinyl]-2-methoxybenzamide?

The InChIKey is JJKDTGADKIFSOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13ClN4O4/c1-26-14-5-4-12(20)10-13(14)17(25)22-16-9-11(6-7-21-16)18-23-24-19(28-18)15-3-2-8-27-15/h2-10H,1H3,(H,21,22,25).

What are the key properties of 5-chloro-N-[4-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-2-pyridinyl]-2-methoxybenzamide?

5-chloro-N-[4-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-2-pyridinyl]-2-methoxybenzamide has a molecular weight of 396.79 g/mol, XLogP of 4.31, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for 5-chloro-N-[4-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-2-pyridinyl]-2-methoxybenzamide is sourced from PubChem (CID 142440199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).