N-(4-methyl-1,2,5-oxadiazol-3-yl)-2-[4-[6-(pyridin-2-ylamino)-2-pyridinyl]piperidin-1-yl]acetamide

C20H23N7O2 — CID 110093855

About N-(4-methyl-1,2,5-oxadiazol-3-yl)-2-[4-[6-(pyridin-2-ylamino)-2-pyridinyl]piperidin-1-yl]acetamide

N-(4-methyl-1,2,5-oxadiazol-3-yl)-2-[4-[6-(pyridin-2-ylamino)-2-pyridinyl]piperidin-1-yl]acetamide (PubChem CID 110093855) has the molecular formula C20H23N7O2 and a molecular weight of 393.45 g/mol. Its IUPAC name is N-(4-methyl-1,2,5-oxadiazol-3-yl)-2-[4-[6-(pyridin-2-ylamino)-2-pyridinyl]piperidin-1-yl]acetamide.

Molecular Properties

• Compound Name: N-(4-methyl-1,2,5-oxadiazol-3-yl)-2-[4-[6-(pyridin-2-ylamino)-2-pyridinyl]piperidin-1-yl]acetamide
• PubChem CID: 110093855
• Molecular Formula: C20H23N7O2
• Molecular Weight: 393.45 g/mol
• Exact Mass: 393.19
• IUPAC Name: N-(4-methyl-1,2,5-oxadiazol-3-yl)-2-[4-[6-(pyridin-2-ylamino)-2-pyridinyl]piperidin-1-yl]acetamide
• SMILES: Cc1nonc1NC(=O)CN1CCC(c2cccc(Nc3ccccn3)n2)CC1
• InChI: InChI=1S/C20H23N7O2/c1-14-20(26-29-25-14)24-19(28)13-27-11-8-15(9-12-27)16-5-4-7-18(22-16)23-17-6-2-3-10-21-17/h2-7,10,15H,8-9,11-13H2,1H3,(H,21,22,23)(H,24,26,28)
• InChIKey: CWRUVANVKKZCKV-UHFFFAOYSA-N
• XLogP: 2.73
• TPSA: 109.07 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 8
• Rotatable Bonds: 6
• Heavy Atoms: 29
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	393.45
LogP ≤ 5	2.73
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	8

Frequently Asked Questions

What is the IUPAC name of N-(4-methyl-1,2,5-oxadiazol-3-yl)-2-[4-[6-(pyridin-2-ylamino)-2-pyridinyl]piperidin-1-yl]acetamide?

The IUPAC name of N-(4-methyl-1,2,5-oxadiazol-3-yl)-2-[4-[6-(pyridin-2-ylamino)-2-pyridinyl]piperidin-1-yl]acetamide (CID 110093855) is N-(4-methyl-1,2,5-oxadiazol-3-yl)-2-[4-[6-(pyridin-2-ylamino)-2-pyridinyl]piperidin-1-yl]acetamide.

What is the SMILES notation for N-(4-methyl-1,2,5-oxadiazol-3-yl)-2-[4-[6-(pyridin-2-ylamino)-2-pyridinyl]piperidin-1-yl]acetamide?

The canonical SMILES for N-(4-methyl-1,2,5-oxadiazol-3-yl)-2-[4-[6-(pyridin-2-ylamino)-2-pyridinyl]piperidin-1-yl]acetamide is Cc1nonc1NC(=O)CN1CCC(c2cccc(Nc3ccccn3)n2)CC1.

What is the InChIKey of N-(4-methyl-1,2,5-oxadiazol-3-yl)-2-[4-[6-(pyridin-2-ylamino)-2-pyridinyl]piperidin-1-yl]acetamide?

The InChIKey is CWRUVANVKKZCKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N7O2/c1-14-20(26-29-25-14)24-19(28)13-27-11-8-15(9-12-27)16-5-4-7-18(22-16)23-17-6-2-3-10-21-17/h2-7,10,15H,8-9,11-13H2,1H3,(H,21,22,23)(H,24,26,28).

What are the key properties of N-(4-methyl-1,2,5-oxadiazol-3-yl)-2-[4-[6-(pyridin-2-ylamino)-2-pyridinyl]piperidin-1-yl]acetamide?

N-(4-methyl-1,2,5-oxadiazol-3-yl)-2-[4-[6-(pyridin-2-ylamino)-2-pyridinyl]piperidin-1-yl]acetamide has a molecular weight of 393.45 g/mol, XLogP of 2.73, 6 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for N-(4-methyl-1,2,5-oxadiazol-3-yl)-2-[4-[6-(pyridin-2-ylamino)-2-pyridinyl]piperidin-1-yl]acetamide is sourced from PubChem (CID 110093855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).