3-[[2-(6-fluoro-1H-benzimidazol-2-yl)piperidin-1-yl]methyl]-N-methyl-1,2,4-oxadiazole-5-carboxamide

C17H19FN6O2 — CID 56900944

About 3-[[2-(6-fluoro-1H-benzimidazol-2-yl)piperidin-1-yl]methyl]-N-methyl-1,2,4-oxadiazole-5-carboxamide

3-[[2-(6-fluoro-1H-benzimidazol-2-yl)piperidin-1-yl]methyl]-N-methyl-1,2,4-oxadiazole-5-carboxamide (PubChem CID 56900944) has the molecular formula C17H19FN6O2 and a molecular weight of 358.38 g/mol. Its IUPAC name is 3-[[2-(6-fluoro-1H-benzimidazol-2-yl)piperidin-1-yl]methyl]-N-methyl-1,2,4-oxadiazole-5-carboxamide.

Molecular Properties

• Compound Name: 3-[[2-(6-fluoro-1H-benzimidazol-2-yl)piperidin-1-yl]methyl]-N-methyl-1,2,4-oxadiazole-5-carboxamide
• PubChem CID: 56900944
• Molecular Formula: C17H19FN6O2
• Molecular Weight: 358.38 g/mol
• Exact Mass: 358.16
• IUPAC Name: 3-[[2-(6-fluoro-1H-benzimidazol-2-yl)piperidin-1-yl]methyl]-N-methyl-1,2,4-oxadiazole-5-carboxamide
• SMILES: CNC(=O)c1nc(CN2CCCCC2c2nc3ccc(F)cc3[nH]2)no1
• InChI: InChI=1S/C17H19FN6O2/c1-19-16(25)17-22-14(23-26-17)9-24-7-3-2-4-13(24)15-20-11-6-5-10(18)8-12(11)21-15/h5-6,8,13H,2-4,7,9H2,1H3,(H,19,25)(H,20,21)
• InChIKey: XSXZTYRXASIZFL-UHFFFAOYSA-N
• XLogP: 2.17
• TPSA: 99.94 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 6
• Rotatable Bonds: 4
• Heavy Atoms: 26
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	358.38
LogP ≤ 5	2.17
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 3-[[2-(6-fluoro-1H-benzimidazol-2-yl)piperidin-1-yl]methyl]-N-methyl-1,2,4-oxadiazole-5-carboxamide?

The IUPAC name of 3-[[2-(6-fluoro-1H-benzimidazol-2-yl)piperidin-1-yl]methyl]-N-methyl-1,2,4-oxadiazole-5-carboxamide (CID 56900944) is 3-[[2-(6-fluoro-1H-benzimidazol-2-yl)piperidin-1-yl]methyl]-N-methyl-1,2,4-oxadiazole-5-carboxamide.

What is the SMILES notation for 3-[[2-(6-fluoro-1H-benzimidazol-2-yl)piperidin-1-yl]methyl]-N-methyl-1,2,4-oxadiazole-5-carboxamide?

The canonical SMILES for 3-[[2-(6-fluoro-1H-benzimidazol-2-yl)piperidin-1-yl]methyl]-N-methyl-1,2,4-oxadiazole-5-carboxamide is CNC(=O)c1nc(CN2CCCCC2c2nc3ccc(F)cc3[nH]2)no1.

What is the InChIKey of 3-[[2-(6-fluoro-1H-benzimidazol-2-yl)piperidin-1-yl]methyl]-N-methyl-1,2,4-oxadiazole-5-carboxamide?

The InChIKey is XSXZTYRXASIZFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19FN6O2/c1-19-16(25)17-22-14(23-26-17)9-24-7-3-2-4-13(24)15-20-11-6-5-10(18)8-12(11)21-15/h5-6,8,13H,2-4,7,9H2,1H3,(H,19,25)(H,20,21).

What are the key properties of 3-[[2-(6-fluoro-1H-benzimidazol-2-yl)piperidin-1-yl]methyl]-N-methyl-1,2,4-oxadiazole-5-carboxamide?

3-[[2-(6-fluoro-1H-benzimidazol-2-yl)piperidin-1-yl]methyl]-N-methyl-1,2,4-oxadiazole-5-carboxamide has a molecular weight of 358.38 g/mol, XLogP of 2.17, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 3-[[2-(6-fluoro-1H-benzimidazol-2-yl)piperidin-1-yl]methyl]-N-methyl-1,2,4-oxadiazole-5-carboxamide is sourced from PubChem (CID 56900944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).