N-[2-[methyl-[2-[(4-methyl-2-pyridinyl)amino]-2-oxoethyl]amino]-2-oxo-1-phenylethyl]benzamide

C24H24N4O3 — CID 56523143

About N-[2-[methyl-[2-[(4-methyl-2-pyridinyl)amino]-2-oxoethyl]amino]-2-oxo-1-phenylethyl]benzamide

N-[2-[methyl-[2-[(4-methyl-2-pyridinyl)amino]-2-oxoethyl]amino]-2-oxo-1-phenylethyl]benzamide (PubChem CID 56523143) has the molecular formula C24H24N4O3 and a molecular weight of 416.48 g/mol. Its IUPAC name is N-[2-[methyl-[2-[(4-methyl-2-pyridinyl)amino]-2-oxoethyl]amino]-2-oxo-1-phenylethyl]benzamide.

Molecular Properties

• Compound Name: N-[2-[methyl-[2-[(4-methyl-2-pyridinyl)amino]-2-oxoethyl]amino]-2-oxo-1-phenylethyl]benzamide
• PubChem CID: 56523143
• Molecular Formula: C24H24N4O3
• Molecular Weight: 416.48 g/mol
• Exact Mass: 416.18
• IUPAC Name: N-[2-[methyl-[2-[(4-methyl-2-pyridinyl)amino]-2-oxoethyl]amino]-2-oxo-1-phenylethyl]benzamide
• SMILES: Cc1ccnc(NC(=O)CN(C)C(=O)C(NC(=O)c2ccccc2)c2ccccc2)c1
• InChI: InChI=1S/C24H24N4O3/c1-17-13-14-25-20(15-17)26-21(29)16-28(2)24(31)22(18-9-5-3-6-10-18)27-23(30)19-11-7-4-8-12-19/h3-15,22H,16H2,1-2H3,(H,27,30)(H,25,26,29)
• InChIKey: QZDZBJBBPOWKSS-UHFFFAOYSA-N
• XLogP: 2.96
• TPSA: 91.40 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 4
• Rotatable Bonds: 7
• Heavy Atoms: 31
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	416.48
LogP ≤ 5	2.96
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of N-[2-[methyl-[2-[(4-methyl-2-pyridinyl)amino]-2-oxoethyl]amino]-2-oxo-1-phenylethyl]benzamide?

The IUPAC name of N-[2-[methyl-[2-[(4-methyl-2-pyridinyl)amino]-2-oxoethyl]amino]-2-oxo-1-phenylethyl]benzamide (CID 56523143) is N-[2-[methyl-[2-[(4-methyl-2-pyridinyl)amino]-2-oxoethyl]amino]-2-oxo-1-phenylethyl]benzamide.

What is the SMILES notation for N-[2-[methyl-[2-[(4-methyl-2-pyridinyl)amino]-2-oxoethyl]amino]-2-oxo-1-phenylethyl]benzamide?

The canonical SMILES for N-[2-[methyl-[2-[(4-methyl-2-pyridinyl)amino]-2-oxoethyl]amino]-2-oxo-1-phenylethyl]benzamide is Cc1ccnc(NC(=O)CN(C)C(=O)C(NC(=O)c2ccccc2)c2ccccc2)c1.

What is the InChIKey of N-[2-[methyl-[2-[(4-methyl-2-pyridinyl)amino]-2-oxoethyl]amino]-2-oxo-1-phenylethyl]benzamide?

The InChIKey is QZDZBJBBPOWKSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N4O3/c1-17-13-14-25-20(15-17)26-21(29)16-28(2)24(31)22(18-9-5-3-6-10-18)27-23(30)19-11-7-4-8-12-19/h3-15,22H,16H2,1-2H3,(H,27,30)(H,25,26,29).

What are the key properties of N-[2-[methyl-[2-[(4-methyl-2-pyridinyl)amino]-2-oxoethyl]amino]-2-oxo-1-phenylethyl]benzamide?

N-[2-[methyl-[2-[(4-methyl-2-pyridinyl)amino]-2-oxoethyl]amino]-2-oxo-1-phenylethyl]benzamide has a molecular weight of 416.48 g/mol, XLogP of 2.96, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for N-[2-[methyl-[2-[(4-methyl-2-pyridinyl)amino]-2-oxoethyl]amino]-2-oxo-1-phenylethyl]benzamide is sourced from PubChem (CID 56523143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).