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

C23H23N5O2 — CID 38878531

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

N-(1,3-diphenylpyrazol-5-yl)-2-[methyl-[(5-methyl-1,2-oxazol-3-yl)methyl]amino]acetamide (PubChem CID 38878531) has the molecular formula C23H23N5O2 and a molecular weight of 401.47 g/mol. Its IUPAC name is N-(1,3-diphenylpyrazol-5-yl)-2-[methyl-[(5-methyl-1,2-oxazol-3-yl)methyl]amino]acetamide.

Molecular Properties

• Compound Name: N-(1,3-diphenylpyrazol-5-yl)-2-[methyl-[(5-methyl-1,2-oxazol-3-yl)methyl]amino]acetamide
• PubChem CID: 38878531
• Molecular Formula: C23H23N5O2
• Molecular Weight: 401.47 g/mol
• Exact Mass: 401.19
• IUPAC Name: N-(1,3-diphenylpyrazol-5-yl)-2-[methyl-[(5-methyl-1,2-oxazol-3-yl)methyl]amino]acetamide
• SMILES: Cc1cc(CN(C)CC(=O)Nc2cc(-c3ccccc3)nn2-c2ccccc2)no1
• InChI: InChI=1S/C23H23N5O2/c1-17-13-19(26-30-17)15-27(2)16-23(29)24-22-14-21(18-9-5-3-6-10-18)25-28(22)20-11-7-4-8-12-20/h3-14H,15-16H2,1-2H3,(H,24,29)
• InChIKey: MFJVBDWAWQOURN-UHFFFAOYSA-N
• XLogP: 3.91
• TPSA: 76.19 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 6
• Rotatable Bonds: 7
• Heavy Atoms: 30
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	401.47
LogP ≤ 5	3.91
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

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

The IUPAC name of N-(1,3-diphenylpyrazol-5-yl)-2-[methyl-[(5-methyl-1,2-oxazol-3-yl)methyl]amino]acetamide (CID 38878531) is N-(1,3-diphenylpyrazol-5-yl)-2-[methyl-[(5-methyl-1,2-oxazol-3-yl)methyl]amino]acetamide.

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

The canonical SMILES for N-(1,3-diphenylpyrazol-5-yl)-2-[methyl-[(5-methyl-1,2-oxazol-3-yl)methyl]amino]acetamide is Cc1cc(CN(C)CC(=O)Nc2cc(-c3ccccc3)nn2-c2ccccc2)no1.

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

The InChIKey is MFJVBDWAWQOURN-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N5O2/c1-17-13-19(26-30-17)15-27(2)16-23(29)24-22-14-21(18-9-5-3-6-10-18)25-28(22)20-11-7-4-8-12-20/h3-14H,15-16H2,1-2H3,(H,24,29).

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

N-(1,3-diphenylpyrazol-5-yl)-2-[methyl-[(5-methyl-1,2-oxazol-3-yl)methyl]amino]acetamide has a molecular weight of 401.47 g/mol, XLogP of 3.91, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for N-(1,3-diphenylpyrazol-5-yl)-2-[methyl-[(5-methyl-1,2-oxazol-3-yl)methyl]amino]acetamide is sourced from PubChem (CID 38878531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).