N-(5-methyl-1,2-oxazol-3-yl)-2-[4-[5-[(3-methyl-2-pyridinyl)amino]-2-pyridinyl]piperidin-1-yl]acetamide

C22H26N6O2 — CID 95834159

About N-(5-methyl-1,2-oxazol-3-yl)-2-[4-[5-[(3-methyl-2-pyridinyl)amino]-2-pyridinyl]piperidin-1-yl]acetamide

N-(5-methyl-1,2-oxazol-3-yl)-2-[4-[5-[(3-methyl-2-pyridinyl)amino]-2-pyridinyl]piperidin-1-yl]acetamide (PubChem CID 95834159) has the molecular formula C22H26N6O2 and a molecular weight of 406.49 g/mol. Its IUPAC name is N-(5-methyl-1,2-oxazol-3-yl)-2-[4-[5-[(3-methyl-2-pyridinyl)amino]-2-pyridinyl]piperidin-1-yl]acetamide.

Molecular Properties

• Compound Name: N-(5-methyl-1,2-oxazol-3-yl)-2-[4-[5-[(3-methyl-2-pyridinyl)amino]-2-pyridinyl]piperidin-1-yl]acetamide
• PubChem CID: 95834159
• Molecular Formula: C22H26N6O2
• Molecular Weight: 406.49 g/mol
• Exact Mass: 406.21
• IUPAC Name: N-(5-methyl-1,2-oxazol-3-yl)-2-[4-[5-[(3-methyl-2-pyridinyl)amino]-2-pyridinyl]piperidin-1-yl]acetamide
• SMILES: Cc1cc(NC(=O)CN2CCC(c3ccc(Nc4ncccc4C)cn3)CC2)no1
• InChI: InChI=1S/C22H26N6O2/c1-15-4-3-9-23-22(15)25-18-5-6-19(24-13-18)17-7-10-28(11-8-17)14-21(29)26-20-12-16(2)30-27-20/h3-6,9,12-13,17H,7-8,10-11,14H2,1-2H3,(H,23,25)(H,26,27,29)
• InChIKey: GNHDWHKPWYAMNJ-UHFFFAOYSA-N
• XLogP: 3.64
• TPSA: 96.18 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 7
• Rotatable Bonds: 6
• Heavy Atoms: 30
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	406.49
LogP ≤ 5	3.64
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

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

The IUPAC name of N-(5-methyl-1,2-oxazol-3-yl)-2-[4-[5-[(3-methyl-2-pyridinyl)amino]-2-pyridinyl]piperidin-1-yl]acetamide (CID 95834159) is N-(5-methyl-1,2-oxazol-3-yl)-2-[4-[5-[(3-methyl-2-pyridinyl)amino]-2-pyridinyl]piperidin-1-yl]acetamide.

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

The canonical SMILES for N-(5-methyl-1,2-oxazol-3-yl)-2-[4-[5-[(3-methyl-2-pyridinyl)amino]-2-pyridinyl]piperidin-1-yl]acetamide is Cc1cc(NC(=O)CN2CCC(c3ccc(Nc4ncccc4C)cn3)CC2)no1.

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

The InChIKey is GNHDWHKPWYAMNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N6O2/c1-15-4-3-9-23-22(15)25-18-5-6-19(24-13-18)17-7-10-28(11-8-17)14-21(29)26-20-12-16(2)30-27-20/h3-6,9,12-13,17H,7-8,10-11,14H2,1-2H3,(H,23,25)(H,26,27,29).

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

N-(5-methyl-1,2-oxazol-3-yl)-2-[4-[5-[(3-methyl-2-pyridinyl)amino]-2-pyridinyl]piperidin-1-yl]acetamide has a molecular weight of 406.49 g/mol, XLogP of 3.64, 6 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for N-(5-methyl-1,2-oxazol-3-yl)-2-[4-[5-[(3-methyl-2-pyridinyl)amino]-2-pyridinyl]piperidin-1-yl]acetamide is sourced from PubChem (CID 95834159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).