N-(furan-2-ylmethyl)-5-methyl-1-[4-(3-methyl-1,2,4-oxadiazol-5-yl)-2-pyridinyl]pyrazole-4-carboxamide

C18H16N6O3 — CID 53178948

About N-(furan-2-ylmethyl)-5-methyl-1-[4-(3-methyl-1,2,4-oxadiazol-5-yl)-2-pyridinyl]pyrazole-4-carboxamide

N-(furan-2-ylmethyl)-5-methyl-1-[4-(3-methyl-1,2,4-oxadiazol-5-yl)-2-pyridinyl]pyrazole-4-carboxamide (PubChem CID 53178948) has the molecular formula C18H16N6O3 and a molecular weight of 364.37 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-5-methyl-1-[4-(3-methyl-1,2,4-oxadiazol-5-yl)-2-pyridinyl]pyrazole-4-carboxamide.

Molecular Properties

• Compound Name: N-(furan-2-ylmethyl)-5-methyl-1-[4-(3-methyl-1,2,4-oxadiazol-5-yl)-2-pyridinyl]pyrazole-4-carboxamide
• PubChem CID: 53178948
• Molecular Formula: C18H16N6O3
• Molecular Weight: 364.37 g/mol
• Exact Mass: 364.13
• IUPAC Name: N-(furan-2-ylmethyl)-5-methyl-1-[4-(3-methyl-1,2,4-oxadiazol-5-yl)-2-pyridinyl]pyrazole-4-carboxamide
• SMILES: Cc1noc(-c2ccnc(-n3ncc(C(=O)NCc4ccco4)c3C)c2)n1
• InChI: InChI=1S/C18H16N6O3/c1-11-15(17(25)20-9-14-4-3-7-26-14)10-21-24(11)16-8-13(5-6-19-16)18-22-12(2)23-27-18/h3-8,10H,9H2,1-2H3,(H,20,25)
• InChIKey: ZVJTUTGOWAGSSB-UHFFFAOYSA-N
• XLogP: 2.46
• TPSA: 111.87 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 8
• Rotatable Bonds: 5
• Heavy Atoms: 27
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	364.37
LogP ≤ 5	2.46
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	8

Frequently Asked Questions

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

The IUPAC name of N-(furan-2-ylmethyl)-5-methyl-1-[4-(3-methyl-1,2,4-oxadiazol-5-yl)-2-pyridinyl]pyrazole-4-carboxamide (CID 53178948) is N-(furan-2-ylmethyl)-5-methyl-1-[4-(3-methyl-1,2,4-oxadiazol-5-yl)-2-pyridinyl]pyrazole-4-carboxamide.

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

The canonical SMILES for N-(furan-2-ylmethyl)-5-methyl-1-[4-(3-methyl-1,2,4-oxadiazol-5-yl)-2-pyridinyl]pyrazole-4-carboxamide is Cc1noc(-c2ccnc(-n3ncc(C(=O)NCc4ccco4)c3C)c2)n1.

What is the InChIKey of N-(furan-2-ylmethyl)-5-methyl-1-[4-(3-methyl-1,2,4-oxadiazol-5-yl)-2-pyridinyl]pyrazole-4-carboxamide?

The InChIKey is ZVJTUTGOWAGSSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N6O3/c1-11-15(17(25)20-9-14-4-3-7-26-14)10-21-24(11)16-8-13(5-6-19-16)18-22-12(2)23-27-18/h3-8,10H,9H2,1-2H3,(H,20,25).

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

N-(furan-2-ylmethyl)-5-methyl-1-[4-(3-methyl-1,2,4-oxadiazol-5-yl)-2-pyridinyl]pyrazole-4-carboxamide has a molecular weight of 364.37 g/mol, XLogP of 2.46, 5 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for N-(furan-2-ylmethyl)-5-methyl-1-[4-(3-methyl-1,2,4-oxadiazol-5-yl)-2-pyridinyl]pyrazole-4-carboxamide is sourced from PubChem (CID 53178948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).