N-[2-methyl-1-(7-oxo-2-pyridin-2-yl-1H-pyrazolo[1,5-a]pyrimidin-5-yl)propyl]-2-(4-methylphenyl)acetamide

C24H25N5O2 — CID 110239187

About N-[2-methyl-1-(7-oxo-2-pyridin-2-yl-1H-pyrazolo[1,5-a]pyrimidin-5-yl)propyl]-2-(4-methylphenyl)acetamide

N-[2-methyl-1-(7-oxo-2-pyridin-2-yl-1H-pyrazolo[1,5-a]pyrimidin-5-yl)propyl]-2-(4-methylphenyl)acetamide (PubChem CID 110239187) has the molecular formula C24H25N5O2 and a molecular weight of 415.50 g/mol. Its IUPAC name is N-[2-methyl-1-(7-oxo-2-pyridin-2-yl-1H-pyrazolo[1,5-a]pyrimidin-5-yl)propyl]-2-(4-methylphenyl)acetamide.

Molecular Properties

• Compound Name: N-[2-methyl-1-(7-oxo-2-pyridin-2-yl-1H-pyrazolo[1,5-a]pyrimidin-5-yl)propyl]-2-(4-methylphenyl)acetamide
• PubChem CID: 110239187
• Molecular Formula: C24H25N5O2
• Molecular Weight: 415.50 g/mol
• Exact Mass: 415.20
• IUPAC Name: N-[2-methyl-1-(7-oxo-2-pyridin-2-yl-1H-pyrazolo[1,5-a]pyrimidin-5-yl)propyl]-2-(4-methylphenyl)acetamide
• SMILES: Cc1ccc(CC(=O)NC(c2cc(=O)n3[nH]c(-c4ccccn4)cc3n2)C(C)C)cc1
• InChI: InChI=1S/C24H25N5O2/c1-15(2)24(27-22(30)12-17-9-7-16(3)8-10-17)20-14-23(31)29-21(26-20)13-19(28-29)18-6-4-5-11-25-18/h4-11,13-15,24,28H,12H2,1-3H3,(H,27,30)
• InChIKey: VDLUSWZEMZQEIR-UHFFFAOYSA-N
• XLogP: 3.45
• TPSA: 92.15 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	415.50
LogP ≤ 5	3.45
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of N-[2-methyl-1-(7-oxo-2-pyridin-2-yl-1H-pyrazolo[1,5-a]pyrimidin-5-yl)propyl]-2-(4-methylphenyl)acetamide?

The IUPAC name of N-[2-methyl-1-(7-oxo-2-pyridin-2-yl-1H-pyrazolo[1,5-a]pyrimidin-5-yl)propyl]-2-(4-methylphenyl)acetamide (CID 110239187) is N-[2-methyl-1-(7-oxo-2-pyridin-2-yl-1H-pyrazolo[1,5-a]pyrimidin-5-yl)propyl]-2-(4-methylphenyl)acetamide.

What is the SMILES notation for N-[2-methyl-1-(7-oxo-2-pyridin-2-yl-1H-pyrazolo[1,5-a]pyrimidin-5-yl)propyl]-2-(4-methylphenyl)acetamide?

The canonical SMILES for N-[2-methyl-1-(7-oxo-2-pyridin-2-yl-1H-pyrazolo[1,5-a]pyrimidin-5-yl)propyl]-2-(4-methylphenyl)acetamide is Cc1ccc(CC(=O)NC(c2cc(=O)n3[nH]c(-c4ccccn4)cc3n2)C(C)C)cc1.

What is the InChIKey of N-[2-methyl-1-(7-oxo-2-pyridin-2-yl-1H-pyrazolo[1,5-a]pyrimidin-5-yl)propyl]-2-(4-methylphenyl)acetamide?

The InChIKey is VDLUSWZEMZQEIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25N5O2/c1-15(2)24(27-22(30)12-17-9-7-16(3)8-10-17)20-14-23(31)29-21(26-20)13-19(28-29)18-6-4-5-11-25-18/h4-11,13-15,24,28H,12H2,1-3H3,(H,27,30).

What are the key properties of N-[2-methyl-1-(7-oxo-2-pyridin-2-yl-1H-pyrazolo[1,5-a]pyrimidin-5-yl)propyl]-2-(4-methylphenyl)acetamide?

N-[2-methyl-1-(7-oxo-2-pyridin-2-yl-1H-pyrazolo[1,5-a]pyrimidin-5-yl)propyl]-2-(4-methylphenyl)acetamide has a molecular weight of 415.50 g/mol, XLogP of 3.45, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for N-[2-methyl-1-(7-oxo-2-pyridin-2-yl-1H-pyrazolo[1,5-a]pyrimidin-5-yl)propyl]-2-(4-methylphenyl)acetamide is sourced from PubChem (CID 110239187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).