N-[2-[methyl-[2-oxo-2-[(1-phenyl-2-pyridin-2-ylethyl)amino]ethyl]amino]-2-oxoethyl]benzamide

C25H26N4O3 — CID 134542215

About N-[2-[methyl-[2-oxo-2-[(1-phenyl-2-pyridin-2-ylethyl)amino]ethyl]amino]-2-oxoethyl]benzamide

N-[2-[methyl-[2-oxo-2-[(1-phenyl-2-pyridin-2-ylethyl)amino]ethyl]amino]-2-oxoethyl]benzamide (PubChem CID 134542215) has the molecular formula C25H26N4O3 and a molecular weight of 430.51 g/mol. Its IUPAC name is N-[2-[methyl-[2-oxo-2-[(1-phenyl-2-pyridin-2-ylethyl)amino]ethyl]amino]-2-oxoethyl]benzamide.

Molecular Properties

• Compound Name: N-[2-[methyl-[2-oxo-2-[(1-phenyl-2-pyridin-2-ylethyl)amino]ethyl]amino]-2-oxoethyl]benzamide
• PubChem CID: 134542215
• Molecular Formula: C25H26N4O3
• Molecular Weight: 430.51 g/mol
• Exact Mass: 430.20
• IUPAC Name: N-[2-[methyl-[2-oxo-2-[(1-phenyl-2-pyridin-2-ylethyl)amino]ethyl]amino]-2-oxoethyl]benzamide
• SMILES: CN(CC(=O)NC(Cc1ccccn1)c1ccccc1)C(=O)CNC(=O)c1ccccc1
• InChI: InChI=1S/C25H26N4O3/c1-29(24(31)17-27-25(32)20-12-6-3-7-13-20)18-23(30)28-22(19-10-4-2-5-11-19)16-21-14-8-9-15-26-21/h2-15,22H,16-18H2,1H3,(H,27,32)(H,28,30)
• InChIKey: MUWUMBUYLISLBR-UHFFFAOYSA-N
• XLogP: 2.37
• TPSA: 91.40 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 4
• Rotatable Bonds: 9
• Heavy Atoms: 32
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	430.51
LogP ≤ 5	2.37
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of N-[2-[methyl-[2-oxo-2-[(1-phenyl-2-pyridin-2-ylethyl)amino]ethyl]amino]-2-oxoethyl]benzamide?

The IUPAC name of N-[2-[methyl-[2-oxo-2-[(1-phenyl-2-pyridin-2-ylethyl)amino]ethyl]amino]-2-oxoethyl]benzamide (CID 134542215) is N-[2-[methyl-[2-oxo-2-[(1-phenyl-2-pyridin-2-ylethyl)amino]ethyl]amino]-2-oxoethyl]benzamide.

What is the SMILES notation for N-[2-[methyl-[2-oxo-2-[(1-phenyl-2-pyridin-2-ylethyl)amino]ethyl]amino]-2-oxoethyl]benzamide?

The canonical SMILES for N-[2-[methyl-[2-oxo-2-[(1-phenyl-2-pyridin-2-ylethyl)amino]ethyl]amino]-2-oxoethyl]benzamide is CN(CC(=O)NC(Cc1ccccn1)c1ccccc1)C(=O)CNC(=O)c1ccccc1.

What is the InChIKey of N-[2-[methyl-[2-oxo-2-[(1-phenyl-2-pyridin-2-ylethyl)amino]ethyl]amino]-2-oxoethyl]benzamide?

The InChIKey is MUWUMBUYLISLBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H26N4O3/c1-29(24(31)17-27-25(32)20-12-6-3-7-13-20)18-23(30)28-22(19-10-4-2-5-11-19)16-21-14-8-9-15-26-21/h2-15,22H,16-18H2,1H3,(H,27,32)(H,28,30).

What are the key properties of N-[2-[methyl-[2-oxo-2-[(1-phenyl-2-pyridin-2-ylethyl)amino]ethyl]amino]-2-oxoethyl]benzamide?

N-[2-[methyl-[2-oxo-2-[(1-phenyl-2-pyridin-2-ylethyl)amino]ethyl]amino]-2-oxoethyl]benzamide has a molecular weight of 430.51 g/mol, XLogP of 2.37, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for N-[2-[methyl-[2-oxo-2-[(1-phenyl-2-pyridin-2-ylethyl)amino]ethyl]amino]-2-oxoethyl]benzamide is sourced from PubChem (CID 134542215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).