4-[(1-benzyl-2-oxopyrrolidin-3-yl)amino]-N-hydroxybenzamide

C18H19N3O3 — CID 88849486

IUPAC4-[(1-benzyl-2-oxopyrrolidin-3-yl)amino]-N-hydroxybenzamide
SMILESO=C(NO)c1ccc(NC2CCN(Cc3ccccc3)C2=O)cc1
InChIInChI=1S/C18H19N3O3/c22-17(20-24)14-6-8-15(9-7-14)19-16-10-11-21(18(16)23)12-13-4-2-1-3-5-13/h1-9,16,19,24H,10-12H2,(H,20,22)
InChIKeyALXBWSHZBQTFJJ-UHFFFAOYSA-N
MW325.37 g/mol
LogP2.02
Rot. Bonds5

About 4-[(1-benzyl-2-oxopyrrolidin-3-yl)amino]-N-hydroxybenzamide

4-[(1-benzyl-2-oxopyrrolidin-3-yl)amino]-N-hydroxybenzamide (PubChem CID 88849486) has the molecular formula C18H19N3O3 and a molecular weight of 325.37 g/mol. Its IUPAC name is 4-[(1-benzyl-2-oxopyrrolidin-3-yl)amino]-N-hydroxybenzamide.

Molecular Properties

Compound Name4-[(1-benzyl-2-oxopyrrolidin-3-yl)amino]-N-hydroxybenzamide
PubChem CID88849486
Molecular FormulaC18H19N3O3
Molecular Weight325.37 g/mol
Exact Mass325.14
IUPAC Name4-[(1-benzyl-2-oxopyrrolidin-3-yl)amino]-N-hydroxybenzamide
SMILESO=C(NO)c1ccc(NC2CCN(Cc3ccccc3)C2=O)cc1
InChIInChI=1S/C18H19N3O3/c22-17(20-24)14-6-8-15(9-7-14)19-16-10-11-21(18(16)23)12-13-4-2-1-3-5-13/h1-9,16,19,24H,10-12H2,(H,20,22)
InChIKeyALXBWSHZBQTFJJ-UHFFFAOYSA-N
XLogP2.02
TPSA81.67 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.37
LogP ≤ 52.02
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4-[(1-benzyl-2-oxopyrrolidin-3-yl)amino]-N-hydroxybenzamide?
The IUPAC name of 4-[(1-benzyl-2-oxopyrrolidin-3-yl)amino]-N-hydroxybenzamide (CID 88849486) is 4-[(1-benzyl-2-oxopyrrolidin-3-yl)amino]-N-hydroxybenzamide.
What is the SMILES notation for 4-[(1-benzyl-2-oxopyrrolidin-3-yl)amino]-N-hydroxybenzamide?
The canonical SMILES for 4-[(1-benzyl-2-oxopyrrolidin-3-yl)amino]-N-hydroxybenzamide is O=C(NO)c1ccc(NC2CCN(Cc3ccccc3)C2=O)cc1.
What is the InChIKey of 4-[(1-benzyl-2-oxopyrrolidin-3-yl)amino]-N-hydroxybenzamide?
The InChIKey is ALXBWSHZBQTFJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O3/c22-17(20-24)14-6-8-15(9-7-14)19-16-10-11-21(18(16)23)12-13-4-2-1-3-5-13/h1-9,16,19,24H,10-12H2,(H,20,22).
What are the key properties of 4-[(1-benzyl-2-oxopyrrolidin-3-yl)amino]-N-hydroxybenzamide?
4-[(1-benzyl-2-oxopyrrolidin-3-yl)amino]-N-hydroxybenzamide has a molecular weight of 325.37 g/mol, XLogP of 2.02, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(1-benzyl-2-oxopyrrolidin-3-yl)amino]-N-hydroxybenzamide is sourced from PubChem (CID 88849486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).