N-[3-[2-(hydroxyamino)-2-oxoethyl]-1-methyl-5-oxopyrrolidin-3-yl]-4-[(2-methylquinolin-4-yl)methoxy]benzamide;N-[3-[2-(hydroxyamino)-2-oxoethyl]-5-oxopyrrolidin-3-yl]-4-[(2-methylquinolin-4-yl)methoxy]benzamide

C49H50N8O10 — CID 158634046

About N-[3-[2-(hydroxyamino)-2-oxoethyl]-1-methyl-5-oxopyrrolidin-3-yl]-4-[(2-methylquinolin-4-yl)methoxy]benzamide;N-[3-[2-(hydroxyamino)-2-oxoethyl]-5-oxopyrrolidin-3-yl]-4-[(2-methylquinolin-4-yl)methoxy]benzamide

N-[3-[2-(hydroxyamino)-2-oxoethyl]-1-methyl-5-oxopyrrolidin-3-yl]-4-[(2-methylquinolin-4-yl)methoxy]benzamide;N-[3-[2-(hydroxyamino)-2-oxoethyl]-5-oxopyrrolidin-3-yl]-4-[(2-methylquinolin-4-yl)methoxy]benzamide (PubChem CID 158634046) has the molecular formula C49H50N8O10 and a molecular weight of 910.99 g/mol. Its IUPAC name is N-[3-[2-(hydroxyamino)-2-oxoethyl]-1-methyl-5-oxopyrrolidin-3-yl]-4-[(2-methylquinolin-4-yl)methoxy]benzamide;N-[3-[2-(hydroxyamino)-2-oxoethyl]-5-oxopyrrolidin-3-yl]-4-[(2-methylquinolin-4-yl)methoxy]benzamide.

Molecular Properties

• Compound Name: N-[3-[2-(hydroxyamino)-2-oxoethyl]-1-methyl-5-oxopyrrolidin-3-yl]-4-[(2-methylquinolin-4-yl)methoxy]benzamide;N-[3-[2-(hydroxyamino)-2-oxoethyl]-5-oxopyrrolidin-3-yl]-4-[(2-methylquinolin-4-yl)methoxy]benzamide
• PubChem CID: 158634046
• Molecular Formula: C49H50N8O10
• Molecular Weight: 910.99 g/mol
• Exact Mass: 910.36
• IUPAC Name: N-[3-[2-(hydroxyamino)-2-oxoethyl]-1-methyl-5-oxopyrrolidin-3-yl]-4-[(2-methylquinolin-4-yl)methoxy]benzamide;N-[3-[2-(hydroxyamino)-2-oxoethyl]-5-oxopyrrolidin-3-yl]-4-[(2-methylquinolin-4-yl)methoxy]benzamide
• SMILES: Cc1cc(COc2ccc(C(=O)NC3(CC(=O)NO)CC(=O)N(C)C3)cc2)c2ccccc2n1.Cc1cc(COc2ccc(C(=O)NC3(CC(=O)NO)CNC(=O)C3)cc2)c2ccccc2n1
• InChI: InChI=1S/C25H26N4O5.C24H24N4O5/c1-16-11-18(20-5-3-4-6-21(20)26-16)14-34-19-9-7-17(8-10-19)24(32)27-25(12-22(30)28-33)13-23(31)29(2)15-25;1-15-10-17(19-4-2-3-5-20(19)26-15)13-33-18-8-6-16(7-9-18)23(31)27-24(12-22(30)28-32)11-21(29)25-14-24/h3-11,33H,12-15H2,1-2H3,(H,27,32)(H,28,30);2-10,32H,11-14H2,1H3,(H,25,29)(H,27,31)(H,28,30)
• InChIKey: HZNXKWNOGVRSPF-UHFFFAOYSA-N
• XLogP: 4.35
• TPSA: 250.51 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 12
• Rotatable Bonds: 14
• Heavy Atoms: 67
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	910.99
LogP ≤ 5	4.35
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	12

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N-[3-[2-(hydroxyamino)-2-oxoethyl]-1-methyl-5-oxopyrrolidin-3-yl]-4-[(2-methylquinolin-4-yl)methoxy]benzamide;N-[3-[2-(hydroxyamino)-2-oxoethyl]-5-oxopyrrolidin-3-yl]-4-[(2-methylquinolin-4-yl)methoxy]benzamide?

The IUPAC name of N-[3-[2-(hydroxyamino)-2-oxoethyl]-1-methyl-5-oxopyrrolidin-3-yl]-4-[(2-methylquinolin-4-yl)methoxy]benzamide;N-[3-[2-(hydroxyamino)-2-oxoethyl]-5-oxopyrrolidin-3-yl]-4-[(2-methylquinolin-4-yl)methoxy]benzamide (CID 158634046) is N-[3-[2-(hydroxyamino)-2-oxoethyl]-1-methyl-5-oxopyrrolidin-3-yl]-4-[(2-methylquinolin-4-yl)methoxy]benzamide;N-[3-[2-(hydroxyamino)-2-oxoethyl]-5-oxopyrrolidin-3-yl]-4-[(2-methylquinolin-4-yl)methoxy]benzamide.

What is the SMILES notation for N-[3-[2-(hydroxyamino)-2-oxoethyl]-1-methyl-5-oxopyrrolidin-3-yl]-4-[(2-methylquinolin-4-yl)methoxy]benzamide;N-[3-[2-(hydroxyamino)-2-oxoethyl]-5-oxopyrrolidin-3-yl]-4-[(2-methylquinolin-4-yl)methoxy]benzamide?

The canonical SMILES for N-[3-[2-(hydroxyamino)-2-oxoethyl]-1-methyl-5-oxopyrrolidin-3-yl]-4-[(2-methylquinolin-4-yl)methoxy]benzamide;N-[3-[2-(hydroxyamino)-2-oxoethyl]-5-oxopyrrolidin-3-yl]-4-[(2-methylquinolin-4-yl)methoxy]benzamide is Cc1cc(COc2ccc(C(=O)NC3(CC(=O)NO)CC(=O)N(C)C3)cc2)c2ccccc2n1.Cc1cc(COc2ccc(C(=O)NC3(CC(=O)NO)CNC(=O)C3)cc2)c2ccccc2n1.

What is the InChIKey of N-[3-[2-(hydroxyamino)-2-oxoethyl]-1-methyl-5-oxopyrrolidin-3-yl]-4-[(2-methylquinolin-4-yl)methoxy]benzamide;N-[3-[2-(hydroxyamino)-2-oxoethyl]-5-oxopyrrolidin-3-yl]-4-[(2-methylquinolin-4-yl)methoxy]benzamide?

The InChIKey is HZNXKWNOGVRSPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H26N4O5.C24H24N4O5/c1-16-11-18(20-5-3-4-6-21(20)26-16)14-34-19-9-7-17(8-10-19)24(32)27-25(12-22(30)28-33)13-23(31)29(2)15-25;1-15-10-17(19-4-2-3-5-20(19)26-15)13-33-18-8-6-16(7-9-18)23(31)27-24(12-22(30)28-32)11-21(29)25-14-24/h3-11,33H,12-15H2,1-2H3,(H,27,32)(H,28,30);2-10,32H,11-14H2,1H3,(H,25,29)(H,27,31)(H,28,30).

What are the key properties of N-[3-[2-(hydroxyamino)-2-oxoethyl]-1-methyl-5-oxopyrrolidin-3-yl]-4-[(2-methylquinolin-4-yl)methoxy]benzamide;N-[3-[2-(hydroxyamino)-2-oxoethyl]-5-oxopyrrolidin-3-yl]-4-[(2-methylquinolin-4-yl)methoxy]benzamide?

N-[3-[2-(hydroxyamino)-2-oxoethyl]-1-methyl-5-oxopyrrolidin-3-yl]-4-[(2-methylquinolin-4-yl)methoxy]benzamide;N-[3-[2-(hydroxyamino)-2-oxoethyl]-5-oxopyrrolidin-3-yl]-4-[(2-methylquinolin-4-yl)methoxy]benzamide has a molecular weight of 910.99 g/mol, XLogP of 4.35, 14 rotatable bonds, 7 hydrogen bond donors, and 12 hydrogen bond acceptors.

Where does this data come from?

All data for N-[3-[2-(hydroxyamino)-2-oxoethyl]-1-methyl-5-oxopyrrolidin-3-yl]-4-[(2-methylquinolin-4-yl)methoxy]benzamide;N-[3-[2-(hydroxyamino)-2-oxoethyl]-5-oxopyrrolidin-3-yl]-4-[(2-methylquinolin-4-yl)methoxy]benzamide is sourced from PubChem (CID 158634046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).