4-[[4-benzyl-2,5-dioxo-3-(pyridin-2-ylmethyl)imidazolidin-1-yl]methyl]-N-hydroxybenzamide

C24H22N4O4 — CID 164611457

IUPAC4-[[4-benzyl-2,5-dioxo-3-(pyridin-2-ylmethyl)imidazolidin-1-yl]methyl]-N-hydroxybenzamide
SMILESO=C(NO)c1ccc(CN2C(=O)C(Cc3ccccc3)N(Cc3ccccn3)C2=O)cc1
InChIInChI=1S/C24H22N4O4/c29-22(26-32)19-11-9-18(10-12-19)15-28-23(30)21(14-17-6-2-1-3-7-17)27(24(28)31)16-20-8-4-5-13-25-20/h1-13,21,32H,14-16H2,(H,26,29)
InChIKeyQNQHJPVWXIDHSZ-UHFFFAOYSA-N
MW430.46 g/mol
LogP2.78
Rot. Bonds7

About 4-[[4-benzyl-2,5-dioxo-3-(pyridin-2-ylmethyl)imidazolidin-1-yl]methyl]-N-hydroxybenzamide

4-[[4-benzyl-2,5-dioxo-3-(pyridin-2-ylmethyl)imidazolidin-1-yl]methyl]-N-hydroxybenzamide (PubChem CID 164611457) has the molecular formula C24H22N4O4 and a molecular weight of 430.46 g/mol. Its IUPAC name is 4-[[4-benzyl-2,5-dioxo-3-(pyridin-2-ylmethyl)imidazolidin-1-yl]methyl]-N-hydroxybenzamide.

Molecular Properties

Compound Name4-[[4-benzyl-2,5-dioxo-3-(pyridin-2-ylmethyl)imidazolidin-1-yl]methyl]-N-hydroxybenzamide
PubChem CID164611457
Molecular FormulaC24H22N4O4
Molecular Weight430.46 g/mol
Exact Mass430.16
IUPAC Name4-[[4-benzyl-2,5-dioxo-3-(pyridin-2-ylmethyl)imidazolidin-1-yl]methyl]-N-hydroxybenzamide
SMILESO=C(NO)c1ccc(CN2C(=O)C(Cc3ccccc3)N(Cc3ccccn3)C2=O)cc1
InChIInChI=1S/C24H22N4O4/c29-22(26-32)19-11-9-18(10-12-19)15-28-23(30)21(14-17-6-2-1-3-7-17)27(24(28)31)16-20-8-4-5-13-25-20/h1-13,21,32H,14-16H2,(H,26,29)
InChIKeyQNQHJPVWXIDHSZ-UHFFFAOYSA-N
XLogP2.78
TPSA102.84 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500430.46
LogP ≤ 52.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 4-[[4-benzyl-2,5-dioxo-3-(pyridin-2-ylmethyl)imidazolidin-1-yl]methyl]-N-hydroxybenzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-[[4-benzyl-2,5-dioxo-3-(pyridin-2-ylmethyl)imidazolidin-1-yl]methyl]-N-hydroxybenzamide?
The IUPAC name of 4-[[4-benzyl-2,5-dioxo-3-(pyridin-2-ylmethyl)imidazolidin-1-yl]methyl]-N-hydroxybenzamide (CID 164611457) is 4-[[4-benzyl-2,5-dioxo-3-(pyridin-2-ylmethyl)imidazolidin-1-yl]methyl]-N-hydroxybenzamide.
What is the SMILES notation for 4-[[4-benzyl-2,5-dioxo-3-(pyridin-2-ylmethyl)imidazolidin-1-yl]methyl]-N-hydroxybenzamide?
The canonical SMILES for 4-[[4-benzyl-2,5-dioxo-3-(pyridin-2-ylmethyl)imidazolidin-1-yl]methyl]-N-hydroxybenzamide is O=C(NO)c1ccc(CN2C(=O)C(Cc3ccccc3)N(Cc3ccccn3)C2=O)cc1.
What is the InChIKey of 4-[[4-benzyl-2,5-dioxo-3-(pyridin-2-ylmethyl)imidazolidin-1-yl]methyl]-N-hydroxybenzamide?
The InChIKey is QNQHJPVWXIDHSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22N4O4/c29-22(26-32)19-11-9-18(10-12-19)15-28-23(30)21(14-17-6-2-1-3-7-17)27(24(28)31)16-20-8-4-5-13-25-20/h1-13,21,32H,14-16H2,(H,26,29).
What are the key properties of 4-[[4-benzyl-2,5-dioxo-3-(pyridin-2-ylmethyl)imidazolidin-1-yl]methyl]-N-hydroxybenzamide?
4-[[4-benzyl-2,5-dioxo-3-(pyridin-2-ylmethyl)imidazolidin-1-yl]methyl]-N-hydroxybenzamide has a molecular weight of 430.46 g/mol, XLogP of 2.78, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[4-benzyl-2,5-dioxo-3-(pyridin-2-ylmethyl)imidazolidin-1-yl]methyl]-N-hydroxybenzamide is sourced from PubChem (CID 164611457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).