5-[(3R)-1-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-3-yl]-1H-pyrazole-3-carboxamide

C14H20N6O2 — CID 96514043

About 5-[(3R)-1-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-3-yl]-1H-pyrazole-3-carboxamide

5-[(3R)-1-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-3-yl]-1H-pyrazole-3-carboxamide (PubChem CID 96514043) has the molecular formula C14H20N6O2 and a molecular weight of 304.35 g/mol. Its IUPAC name is 5-[(3R)-1-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-3-yl]-1H-pyrazole-3-carboxamide.

Molecular Properties

• Compound Name: 5-[(3R)-1-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-3-yl]-1H-pyrazole-3-carboxamide
• PubChem CID: 96514043
• Molecular Formula: C14H20N6O2
• Molecular Weight: 304.35 g/mol
• Exact Mass: 304.16
• IUPAC Name: 5-[(3R)-1-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-3-yl]-1H-pyrazole-3-carboxamide
• SMILES: CCc1nc(CN2CCC[C@@H](c3cc(C(N)=O)n[nH]3)C2)no1
• InChI: InChI=1S/C14H20N6O2/c1-2-13-16-12(19-22-13)8-20-5-3-4-9(7-20)10-6-11(14(15)21)18-17-10/h6,9H,2-5,7-8H2,1H3,(H2,15,21)(H,17,18)/t9-/m1/s1
• InChIKey: VIOMSKNUVQWZCC-SECBINFHSA-N
• XLogP: 0.83
• TPSA: 113.93 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 6
• Rotatable Bonds: 5
• Heavy Atoms: 22
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	304.35
LogP ≤ 5	0.83
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 5-[(3R)-1-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-3-yl]-1H-pyrazole-3-carboxamide?

The IUPAC name of 5-[(3R)-1-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-3-yl]-1H-pyrazole-3-carboxamide (CID 96514043) is 5-[(3R)-1-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-3-yl]-1H-pyrazole-3-carboxamide.

What is the SMILES notation for 5-[(3R)-1-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-3-yl]-1H-pyrazole-3-carboxamide?

The canonical SMILES for 5-[(3R)-1-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-3-yl]-1H-pyrazole-3-carboxamide is CCc1nc(CN2CCC[C@@H](c3cc(C(N)=O)n[nH]3)C2)no1.

What is the InChIKey of 5-[(3R)-1-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-3-yl]-1H-pyrazole-3-carboxamide?

The InChIKey is VIOMSKNUVQWZCC-SECBINFHSA-N. The full InChI is InChI=1S/C14H20N6O2/c1-2-13-16-12(19-22-13)8-20-5-3-4-9(7-20)10-6-11(14(15)21)18-17-10/h6,9H,2-5,7-8H2,1H3,(H2,15,21)(H,17,18)/t9-/m1/s1.

What are the key properties of 5-[(3R)-1-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-3-yl]-1H-pyrazole-3-carboxamide?

5-[(3R)-1-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-3-yl]-1H-pyrazole-3-carboxamide has a molecular weight of 304.35 g/mol, XLogP of 0.83, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 5-[(3R)-1-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-3-yl]-1H-pyrazole-3-carboxamide is sourced from PubChem (CID 96514043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).