2-hydroxy-5-iodo-N-(5-oxopyrrolidin-3-yl)benzamide

C11H11IN2O3 — CID 103526859

IUPAC2-hydroxy-5-iodo-N-(5-oxopyrrolidin-3-yl)benzamide
SMILESO=C1CC(NC(=O)c2cc(I)ccc2O)CN1
InChIInChI=1S/C11H11IN2O3/c12-6-1-2-9(15)8(3-6)11(17)14-7-4-10(16)13-5-7/h1-3,7,15H,4-5H2,(H,13,16)(H,14,17)
InChIKeyDFPYADRCXXKJJH-UHFFFAOYSA-N
MW346.12 g/mol
LogP0.62
Rot. Bonds2

About 2-hydroxy-5-iodo-N-(5-oxopyrrolidin-3-yl)benzamide

2-hydroxy-5-iodo-N-(5-oxopyrrolidin-3-yl)benzamide (PubChem CID 103526859) has the molecular formula C11H11IN2O3 and a molecular weight of 346.12 g/mol. Its IUPAC name is 2-hydroxy-5-iodo-N-(5-oxopyrrolidin-3-yl)benzamide.

Molecular Properties

Compound Name2-hydroxy-5-iodo-N-(5-oxopyrrolidin-3-yl)benzamide
PubChem CID103526859
Molecular FormulaC11H11IN2O3
Molecular Weight346.12 g/mol
Exact Mass345.98
IUPAC Name2-hydroxy-5-iodo-N-(5-oxopyrrolidin-3-yl)benzamide
SMILESO=C1CC(NC(=O)c2cc(I)ccc2O)CN1
InChIInChI=1S/C11H11IN2O3/c12-6-1-2-9(15)8(3-6)11(17)14-7-4-10(16)13-5-7/h1-3,7,15H,4-5H2,(H,13,16)(H,14,17)
InChIKeyDFPYADRCXXKJJH-UHFFFAOYSA-N
XLogP0.62
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.12
LogP ≤ 50.62
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

2-hydroxy-5-iodo-N-[(3S)-pyrrolidin-3-yl]benzamide
CID 107732166
2-hydroxy-5-iodo-N-(thiolan-3-yl)benzamide
CID 103711939
2-hydroxy-5-iodo-N-(3-methoxycyclobutyl)benzamide
CID 104600964
2-amino-3-fluoro-N-(5-oxopyrrolidin-3-yl)benzamide
CID 106187784
N-(1,1-dioxothian-3-yl)-2-hydroxy-5-iodobenzamide
CID 103710763
3-[(5-oxopyrrolidin-3-yl)carbamoyl]benzoic acid
CID 114156972
N-(5-oxopyrrolidin-3-yl)-4-sulfanylbenzamide
CID 106198052
2-amino-5-methoxy-N-(5-oxopyrrolidin-3-yl)benzamide
CID 106179800
4-amino-2-methoxy-N-(5-oxopyrrolidin-3-yl)benzamide
CID 114154678
4-hydrazinyl-N-(5-oxopyrrolidin-3-yl)pyridine-3-carboxamide
CID 106197858
2-hydroxy-N-[(1R,2S)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]-5-iodobenzamide
CID 103525566
5-chloro-2-nitro-N-(5-oxopyrrolidin-3-yl)benzamide
CID 113358036

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-5-iodo-N-(5-oxopyrrolidin-3-yl)benzamide?
The IUPAC name of 2-hydroxy-5-iodo-N-(5-oxopyrrolidin-3-yl)benzamide (CID 103526859) is 2-hydroxy-5-iodo-N-(5-oxopyrrolidin-3-yl)benzamide.
What is the SMILES notation for 2-hydroxy-5-iodo-N-(5-oxopyrrolidin-3-yl)benzamide?
The canonical SMILES for 2-hydroxy-5-iodo-N-(5-oxopyrrolidin-3-yl)benzamide is O=C1CC(NC(=O)c2cc(I)ccc2O)CN1.
What is the InChIKey of 2-hydroxy-5-iodo-N-(5-oxopyrrolidin-3-yl)benzamide?
The InChIKey is DFPYADRCXXKJJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11IN2O3/c12-6-1-2-9(15)8(3-6)11(17)14-7-4-10(16)13-5-7/h1-3,7,15H,4-5H2,(H,13,16)(H,14,17).
What are the key properties of 2-hydroxy-5-iodo-N-(5-oxopyrrolidin-3-yl)benzamide?
2-hydroxy-5-iodo-N-(5-oxopyrrolidin-3-yl)benzamide has a molecular weight of 346.12 g/mol, XLogP of 0.62, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-5-iodo-N-(5-oxopyrrolidin-3-yl)benzamide is sourced from PubChem (CID 103526859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).