N-(2-fluorophenyl)-2-[4-[6-[(4-methyl-2-pyridinyl)amino]-2-pyridinyl]piperidin-1-yl]acetamide

C24H26FN5O — CID 110095958

About N-(2-fluorophenyl)-2-[4-[6-[(4-methyl-2-pyridinyl)amino]-2-pyridinyl]piperidin-1-yl]acetamide

N-(2-fluorophenyl)-2-[4-[6-[(4-methyl-2-pyridinyl)amino]-2-pyridinyl]piperidin-1-yl]acetamide (PubChem CID 110095958) has the molecular formula C24H26FN5O and a molecular weight of 419.50 g/mol. Its IUPAC name is N-(2-fluorophenyl)-2-[4-[6-[(4-methyl-2-pyridinyl)amino]-2-pyridinyl]piperidin-1-yl]acetamide.

Molecular Properties

• Compound Name: N-(2-fluorophenyl)-2-[4-[6-[(4-methyl-2-pyridinyl)amino]-2-pyridinyl]piperidin-1-yl]acetamide
• PubChem CID: 110095958
• Molecular Formula: C24H26FN5O
• Molecular Weight: 419.50 g/mol
• Exact Mass: 419.21
• IUPAC Name: N-(2-fluorophenyl)-2-[4-[6-[(4-methyl-2-pyridinyl)amino]-2-pyridinyl]piperidin-1-yl]acetamide
• SMILES: Cc1ccnc(Nc2cccc(C3CCN(CC(=O)Nc4ccccc4F)CC3)n2)c1
• InChI: InChI=1S/C24H26FN5O/c1-17-9-12-26-23(15-17)29-22-8-4-7-20(27-22)18-10-13-30(14-11-18)16-24(31)28-21-6-3-2-5-19(21)25/h2-9,12,15,18H,10-11,13-14,16H2,1H3,(H,28,31)(H,26,27,29)
• InChIKey: GLRYKGWASZFOAX-UHFFFAOYSA-N
• XLogP: 4.49
• TPSA: 70.15 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 5
• Rotatable Bonds: 6
• Heavy Atoms: 31
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	419.50
LogP ≤ 5	4.49
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of N-(2-fluorophenyl)-2-[4-[6-[(4-methyl-2-pyridinyl)amino]-2-pyridinyl]piperidin-1-yl]acetamide?

The IUPAC name of N-(2-fluorophenyl)-2-[4-[6-[(4-methyl-2-pyridinyl)amino]-2-pyridinyl]piperidin-1-yl]acetamide (CID 110095958) is N-(2-fluorophenyl)-2-[4-[6-[(4-methyl-2-pyridinyl)amino]-2-pyridinyl]piperidin-1-yl]acetamide.

What is the SMILES notation for N-(2-fluorophenyl)-2-[4-[6-[(4-methyl-2-pyridinyl)amino]-2-pyridinyl]piperidin-1-yl]acetamide?

The canonical SMILES for N-(2-fluorophenyl)-2-[4-[6-[(4-methyl-2-pyridinyl)amino]-2-pyridinyl]piperidin-1-yl]acetamide is Cc1ccnc(Nc2cccc(C3CCN(CC(=O)Nc4ccccc4F)CC3)n2)c1.

What is the InChIKey of N-(2-fluorophenyl)-2-[4-[6-[(4-methyl-2-pyridinyl)amino]-2-pyridinyl]piperidin-1-yl]acetamide?

The InChIKey is GLRYKGWASZFOAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26FN5O/c1-17-9-12-26-23(15-17)29-22-8-4-7-20(27-22)18-10-13-30(14-11-18)16-24(31)28-21-6-3-2-5-19(21)25/h2-9,12,15,18H,10-11,13-14,16H2,1H3,(H,28,31)(H,26,27,29).

What are the key properties of N-(2-fluorophenyl)-2-[4-[6-[(4-methyl-2-pyridinyl)amino]-2-pyridinyl]piperidin-1-yl]acetamide?

N-(2-fluorophenyl)-2-[4-[6-[(4-methyl-2-pyridinyl)amino]-2-pyridinyl]piperidin-1-yl]acetamide has a molecular weight of 419.50 g/mol, XLogP of 4.49, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for N-(2-fluorophenyl)-2-[4-[6-[(4-methyl-2-pyridinyl)amino]-2-pyridinyl]piperidin-1-yl]acetamide is sourced from PubChem (CID 110095958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).