N-[1-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-3-yl]-2-(3-fluoro-2-pyridinyl)acetamide

C18H22FN5O2 — CID 154796864

About N-[1-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-3-yl]-2-(3-fluoro-2-pyridinyl)acetamide

N-[1-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-3-yl]-2-(3-fluoro-2-pyridinyl)acetamide (PubChem CID 154796864) has the molecular formula C18H22FN5O2 and a molecular weight of 359.41 g/mol. Its IUPAC name is N-[1-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-3-yl]-2-(3-fluoro-2-pyridinyl)acetamide.

Molecular Properties

• Compound Name: N-[1-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-3-yl]-2-(3-fluoro-2-pyridinyl)acetamide
• PubChem CID: 154796864
• Molecular Formula: C18H22FN5O2
• Molecular Weight: 359.41 g/mol
• Exact Mass: 359.18
• IUPAC Name: N-[1-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-3-yl]-2-(3-fluoro-2-pyridinyl)acetamide
• SMILES: O=C(Cc1ncccc1F)NC1CCCN(Cc2noc(C3CC3)n2)C1
• InChI: InChI=1S/C18H22FN5O2/c19-14-4-1-7-20-15(14)9-17(25)21-13-3-2-8-24(10-13)11-16-22-18(26-23-16)12-5-6-12/h1,4,7,12-13H,2-3,5-6,8-11H2,(H,21,25)
• InChIKey: JCTVNNWANPPUFM-UHFFFAOYSA-N
• XLogP: 1.80
• TPSA: 84.15 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 6
• Rotatable Bonds: 6
• Heavy Atoms: 26
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	359.41
LogP ≤ 5	1.80
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of N-[1-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-3-yl]-2-(3-fluoro-2-pyridinyl)acetamide?

The IUPAC name of N-[1-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-3-yl]-2-(3-fluoro-2-pyridinyl)acetamide (CID 154796864) is N-[1-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-3-yl]-2-(3-fluoro-2-pyridinyl)acetamide.

What is the SMILES notation for N-[1-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-3-yl]-2-(3-fluoro-2-pyridinyl)acetamide?

The canonical SMILES for N-[1-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-3-yl]-2-(3-fluoro-2-pyridinyl)acetamide is O=C(Cc1ncccc1F)NC1CCCN(Cc2noc(C3CC3)n2)C1.

What is the InChIKey of N-[1-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-3-yl]-2-(3-fluoro-2-pyridinyl)acetamide?

The InChIKey is JCTVNNWANPPUFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22FN5O2/c19-14-4-1-7-20-15(14)9-17(25)21-13-3-2-8-24(10-13)11-16-22-18(26-23-16)12-5-6-12/h1,4,7,12-13H,2-3,5-6,8-11H2,(H,21,25).

What are the key properties of N-[1-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-3-yl]-2-(3-fluoro-2-pyridinyl)acetamide?

N-[1-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-3-yl]-2-(3-fluoro-2-pyridinyl)acetamide has a molecular weight of 359.41 g/mol, XLogP of 1.80, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for N-[1-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-3-yl]-2-(3-fluoro-2-pyridinyl)acetamide is sourced from PubChem (CID 154796864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).