[5-(5-methylfuran-2-yl)-1H-pyrazol-3-yl]-[4-(1,2,4-oxadiazol-3-yl)piperidin-1-yl]methanone

C16H17N5O3 — CID 118780350

About [5-(5-methylfuran-2-yl)-1H-pyrazol-3-yl]-[4-(1,2,4-oxadiazol-3-yl)piperidin-1-yl]methanone

[5-(5-methylfuran-2-yl)-1H-pyrazol-3-yl]-[4-(1,2,4-oxadiazol-3-yl)piperidin-1-yl]methanone (PubChem CID 118780350) has the molecular formula C16H17N5O3 and a molecular weight of 327.34 g/mol. Its IUPAC name is [5-(5-methylfuran-2-yl)-1H-pyrazol-3-yl]-[4-(1,2,4-oxadiazol-3-yl)piperidin-1-yl]methanone.

Molecular Properties

• Compound Name: [5-(5-methylfuran-2-yl)-1H-pyrazol-3-yl]-[4-(1,2,4-oxadiazol-3-yl)piperidin-1-yl]methanone
• PubChem CID: 118780350
• Molecular Formula: C16H17N5O3
• Molecular Weight: 327.34 g/mol
• Exact Mass: 327.13
• IUPAC Name: [5-(5-methylfuran-2-yl)-1H-pyrazol-3-yl]-[4-(1,2,4-oxadiazol-3-yl)piperidin-1-yl]methanone
• SMILES: Cc1ccc(-c2cc(C(=O)N3CCC(c4ncon4)CC3)n[nH]2)o1
• InChI: InChI=1S/C16H17N5O3/c1-10-2-3-14(24-10)12-8-13(19-18-12)16(22)21-6-4-11(5-7-21)15-17-9-23-20-15/h2-3,8-9,11H,4-7H2,1H3,(H,18,19)
• InChIKey: BYFFMPDXFNUAGW-UHFFFAOYSA-N
• XLogP: 2.38
• TPSA: 101.05 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 6
• Rotatable Bonds: 3
• Heavy Atoms: 24
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	327.34
LogP ≤ 5	2.38
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of [5-(5-methylfuran-2-yl)-1H-pyrazol-3-yl]-[4-(1,2,4-oxadiazol-3-yl)piperidin-1-yl]methanone?

The IUPAC name of [5-(5-methylfuran-2-yl)-1H-pyrazol-3-yl]-[4-(1,2,4-oxadiazol-3-yl)piperidin-1-yl]methanone (CID 118780350) is [5-(5-methylfuran-2-yl)-1H-pyrazol-3-yl]-[4-(1,2,4-oxadiazol-3-yl)piperidin-1-yl]methanone.

What is the SMILES notation for [5-(5-methylfuran-2-yl)-1H-pyrazol-3-yl]-[4-(1,2,4-oxadiazol-3-yl)piperidin-1-yl]methanone?

The canonical SMILES for [5-(5-methylfuran-2-yl)-1H-pyrazol-3-yl]-[4-(1,2,4-oxadiazol-3-yl)piperidin-1-yl]methanone is Cc1ccc(-c2cc(C(=O)N3CCC(c4ncon4)CC3)n[nH]2)o1.

What is the InChIKey of [5-(5-methylfuran-2-yl)-1H-pyrazol-3-yl]-[4-(1,2,4-oxadiazol-3-yl)piperidin-1-yl]methanone?

The InChIKey is BYFFMPDXFNUAGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N5O3/c1-10-2-3-14(24-10)12-8-13(19-18-12)16(22)21-6-4-11(5-7-21)15-17-9-23-20-15/h2-3,8-9,11H,4-7H2,1H3,(H,18,19).

What are the key properties of [5-(5-methylfuran-2-yl)-1H-pyrazol-3-yl]-[4-(1,2,4-oxadiazol-3-yl)piperidin-1-yl]methanone?

[5-(5-methylfuran-2-yl)-1H-pyrazol-3-yl]-[4-(1,2,4-oxadiazol-3-yl)piperidin-1-yl]methanone has a molecular weight of 327.34 g/mol, XLogP of 2.38, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for [5-(5-methylfuran-2-yl)-1H-pyrazol-3-yl]-[4-(1,2,4-oxadiazol-3-yl)piperidin-1-yl]methanone is sourced from PubChem (CID 118780350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).