N-[3-[3-benzyl-4-(4-methylpiperazine-1-carbonyl)-2-oxo-1,3-oxazolidin-5-yl]phenyl]acetamide

C24H28N4O4 — CID 42841022

About N-[3-[3-benzyl-4-(4-methylpiperazine-1-carbonyl)-2-oxo-1,3-oxazolidin-5-yl]phenyl]acetamide

N-[3-[3-benzyl-4-(4-methylpiperazine-1-carbonyl)-2-oxo-1,3-oxazolidin-5-yl]phenyl]acetamide (PubChem CID 42841022) has the molecular formula C24H28N4O4 and a molecular weight of 436.51 g/mol. Its IUPAC name is N-[3-[3-benzyl-4-(4-methylpiperazine-1-carbonyl)-2-oxo-1,3-oxazolidin-5-yl]phenyl]acetamide.

Molecular Properties

• Compound Name: N-[3-[3-benzyl-4-(4-methylpiperazine-1-carbonyl)-2-oxo-1,3-oxazolidin-5-yl]phenyl]acetamide
• PubChem CID: 42841022
• Molecular Formula: C24H28N4O4
• Molecular Weight: 436.51 g/mol
• Exact Mass: 436.21
• IUPAC Name: N-[3-[3-benzyl-4-(4-methylpiperazine-1-carbonyl)-2-oxo-1,3-oxazolidin-5-yl]phenyl]acetamide
• SMILES: CC(=O)Nc1cccc(C2OC(=O)N(Cc3ccccc3)C2C(=O)N2CCN(C)CC2)c1
• InChI: InChI=1S/C24H28N4O4/c1-17(29)25-20-10-6-9-19(15-20)22-21(23(30)27-13-11-26(2)12-14-27)28(24(31)32-22)16-18-7-4-3-5-8-18/h3-10,15,21-22H,11-14,16H2,1-2H3,(H,25,29)
• InChIKey: GWDRCDBQXPPHIB-UHFFFAOYSA-N
• XLogP: 2.48
• TPSA: 82.19 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 5
• Rotatable Bonds: 5
• Heavy Atoms: 32
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	436.51
LogP ≤ 5	2.48
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of N-[3-[3-benzyl-4-(4-methylpiperazine-1-carbonyl)-2-oxo-1,3-oxazolidin-5-yl]phenyl]acetamide?

The IUPAC name of N-[3-[3-benzyl-4-(4-methylpiperazine-1-carbonyl)-2-oxo-1,3-oxazolidin-5-yl]phenyl]acetamide (CID 42841022) is N-[3-[3-benzyl-4-(4-methylpiperazine-1-carbonyl)-2-oxo-1,3-oxazolidin-5-yl]phenyl]acetamide.

What is the SMILES notation for N-[3-[3-benzyl-4-(4-methylpiperazine-1-carbonyl)-2-oxo-1,3-oxazolidin-5-yl]phenyl]acetamide?

The canonical SMILES for N-[3-[3-benzyl-4-(4-methylpiperazine-1-carbonyl)-2-oxo-1,3-oxazolidin-5-yl]phenyl]acetamide is CC(=O)Nc1cccc(C2OC(=O)N(Cc3ccccc3)C2C(=O)N2CCN(C)CC2)c1.

What is the InChIKey of N-[3-[3-benzyl-4-(4-methylpiperazine-1-carbonyl)-2-oxo-1,3-oxazolidin-5-yl]phenyl]acetamide?

The InChIKey is GWDRCDBQXPPHIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28N4O4/c1-17(29)25-20-10-6-9-19(15-20)22-21(23(30)27-13-11-26(2)12-14-27)28(24(31)32-22)16-18-7-4-3-5-8-18/h3-10,15,21-22H,11-14,16H2,1-2H3,(H,25,29).

What are the key properties of N-[3-[3-benzyl-4-(4-methylpiperazine-1-carbonyl)-2-oxo-1,3-oxazolidin-5-yl]phenyl]acetamide?

N-[3-[3-benzyl-4-(4-methylpiperazine-1-carbonyl)-2-oxo-1,3-oxazolidin-5-yl]phenyl]acetamide has a molecular weight of 436.51 g/mol, XLogP of 2.48, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for N-[3-[3-benzyl-4-(4-methylpiperazine-1-carbonyl)-2-oxo-1,3-oxazolidin-5-yl]phenyl]acetamide is sourced from PubChem (CID 42841022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).