5-bromo-N-(2-oxopiperidin-3-yl)pyridine-3-sulfonamide

C10H12BrN3O3S — CID 62094279

IUPAC5-bromo-N-(2-oxopiperidin-3-yl)pyridine-3-sulfonamide
SMILESO=C1NCCCC1NS(=O)(=O)c1cncc(Br)c1
InChIInChI=1S/C10H12BrN3O3S/c11-7-4-8(6-12-5-7)18(16,17)14-9-2-1-3-13-10(9)15/h4-6,9,14H,1-3H2,(H,13,15)
InChIKeyUEGMOUPCFIFTIC-UHFFFAOYSA-N
MW334.20 g/mol
LogP0.40
Rot. Bonds3

About 5-bromo-N-(2-oxopiperidin-3-yl)pyridine-3-sulfonamide

5-bromo-N-(2-oxopiperidin-3-yl)pyridine-3-sulfonamide (PubChem CID 62094279) has the molecular formula C10H12BrN3O3S and a molecular weight of 334.20 g/mol. Its IUPAC name is 5-bromo-N-(2-oxopiperidin-3-yl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name5-bromo-N-(2-oxopiperidin-3-yl)pyridine-3-sulfonamide
PubChem CID62094279
Molecular FormulaC10H12BrN3O3S
Molecular Weight334.20 g/mol
Exact Mass332.98
IUPAC Name5-bromo-N-(2-oxopiperidin-3-yl)pyridine-3-sulfonamide
SMILESO=C1NCCCC1NS(=O)(=O)c1cncc(Br)c1
InChIInChI=1S/C10H12BrN3O3S/c11-7-4-8(6-12-5-7)18(16,17)14-9-2-1-3-13-10(9)15/h4-6,9,14H,1-3H2,(H,13,15)
InChIKeyUEGMOUPCFIFTIC-UHFFFAOYSA-N
XLogP0.40
TPSA88.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.20
LogP ≤ 50.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 5-bromo-N-(2-oxopiperidin-3-yl)pyridine-3-sulfonamide with MolForge

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

Launch Full Analysis

Related Compounds

5-(3-hydroxyprop-1-ynyl)-N-(2-oxopiperidin-3-yl)pyridine-3-sulfonamide
CID 62094462
4-bromo-2,6-dichloro-N-(2-oxopiperidin-3-yl)benzenesulfonamide
CID 49149515
N-(2-oxopiperidin-3-yl)benzenesulfonamide
CID 49457209
4-bromo-3-fluoro-N-(2-oxopiperidin-3-yl)benzenesulfonamide
CID 103697534
5-bromo-2-chloro-N-(2-oxoazepan-3-yl)pyridine-3-sulfonamide
CID 61060873
4-bromo-2-fluoro-N-(2-oxopiperidin-3-yl)benzenesulfonamide
CID 116528562
3-fluoro-N-(2-oxopiperidin-3-yl)benzenesulfonamide
CID 49457165
N-[(3S)-2-oxopiperidin-3-yl]-4-(trifluoromethyl)benzenesulfonamide
CID 54761931
3-amino-4-methyl-N-(2-oxopiperidin-3-yl)benzenesulfonamide
CID 62092532
3-[(2-oxopiperidin-3-yl)sulfamoyl]benzoic acid
CID 62091993
3-[(2-oxopiperidin-3-yl)sulfamoyl]-N-pyridin-3-ylbenzamide
CID 74249952
3-amino-5-fluoro-4-methyl-N-(2-oxopiperidin-3-yl)benzenesulfonamide
CID 116791797

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-(2-oxopiperidin-3-yl)pyridine-3-sulfonamide?
The IUPAC name of 5-bromo-N-(2-oxopiperidin-3-yl)pyridine-3-sulfonamide (CID 62094279) is 5-bromo-N-(2-oxopiperidin-3-yl)pyridine-3-sulfonamide.
What is the SMILES notation for 5-bromo-N-(2-oxopiperidin-3-yl)pyridine-3-sulfonamide?
The canonical SMILES for 5-bromo-N-(2-oxopiperidin-3-yl)pyridine-3-sulfonamide is O=C1NCCCC1NS(=O)(=O)c1cncc(Br)c1.
What is the InChIKey of 5-bromo-N-(2-oxopiperidin-3-yl)pyridine-3-sulfonamide?
The InChIKey is UEGMOUPCFIFTIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12BrN3O3S/c11-7-4-8(6-12-5-7)18(16,17)14-9-2-1-3-13-10(9)15/h4-6,9,14H,1-3H2,(H,13,15).
What are the key properties of 5-bromo-N-(2-oxopiperidin-3-yl)pyridine-3-sulfonamide?
5-bromo-N-(2-oxopiperidin-3-yl)pyridine-3-sulfonamide has a molecular weight of 334.20 g/mol, XLogP of 0.40, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-(2-oxopiperidin-3-yl)pyridine-3-sulfonamide is sourced from PubChem (CID 62094279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).