2-amino-5-bromo-N-(3-cyanophenyl)pyridine-3-sulfonamide

C12H9BrN4O2S — CID 62145031

IUPAC2-amino-5-bromo-N-(3-cyanophenyl)pyridine-3-sulfonamide
SMILESN#Cc1cccc(NS(=O)(=O)c2cc(Br)cnc2N)c1
InChIInChI=1S/C12H9BrN4O2S/c13-9-5-11(12(15)16-7-9)20(18,19)17-10-3-1-2-8(4-10)6-14/h1-5,7,17H,(H2,15,16)
InChIKeyNZRSYTJDMMZOHD-UHFFFAOYSA-N
MW353.20 g/mol
LogP2.10
Rot. Bonds3

About 2-amino-5-bromo-N-(3-cyanophenyl)pyridine-3-sulfonamide

2-amino-5-bromo-N-(3-cyanophenyl)pyridine-3-sulfonamide (PubChem CID 62145031) has the molecular formula C12H9BrN4O2S and a molecular weight of 353.20 g/mol. Its IUPAC name is 2-amino-5-bromo-N-(3-cyanophenyl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name2-amino-5-bromo-N-(3-cyanophenyl)pyridine-3-sulfonamide
PubChem CID62145031
Molecular FormulaC12H9BrN4O2S
Molecular Weight353.20 g/mol
Exact Mass351.96
IUPAC Name2-amino-5-bromo-N-(3-cyanophenyl)pyridine-3-sulfonamide
SMILESN#Cc1cccc(NS(=O)(=O)c2cc(Br)cnc2N)c1
InChIInChI=1S/C12H9BrN4O2S/c13-9-5-11(12(15)16-7-9)20(18,19)17-10-3-1-2-8(4-10)6-14/h1-5,7,17H,(H2,15,16)
InChIKeyNZRSYTJDMMZOHD-UHFFFAOYSA-N
XLogP2.10
TPSA108.87 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.20
LogP ≤ 52.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-amino-5-bromo-N-(3-cyanophenyl)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

2-amino-5-bromo-N-(3-iodophenyl)pyridine-3-sulfonamide
CID 55043820
N-(3-acetylphenyl)-2-amino-5-bromopyridine-3-sulfonamide
CID 22515885
2-amino-5-bromo-N-(3-ethoxyphenyl)pyridine-3-sulfonamide
CID 62156694
2-amino-5-bromo-N-(2,6-dimethylphenyl)pyridine-3-sulfonamide
CID 22515848
4-bromo-N-(3-cyanophenyl)-2-fluorobenzenesulfonamide
CID 116527479
2-amino-5-bromo-N-(2,3-dihydro-1H-inden-5-yl)pyridine-3-sulfonamide
CID 62150632
2-amino-5-bromo-N-(3,4,5-trifluorophenyl)pyridine-3-sulfonamide
CID 62813648
2,5-dibromo-N-(3-cyanophenyl)-4-methylbenzenesulfonamide
CID 80711667
2-amino-5-bromo-N-pyridin-2-ylpyridine-3-sulfonamide
CID 55044230
2-amino-5-bromo-N-(3-ethynylphenyl)benzenesulfonamide
CID 61111211
4-amino-N-(3-cyanophenyl)-2-methoxybenzenesulfonamide
CID 43257540
2-amino-5-bromo-N-(4-bromo-2,6-dimethylphenyl)pyridine-3-sulfonamide
CID 62163149

Frequently Asked Questions

What is the IUPAC name of 2-amino-5-bromo-N-(3-cyanophenyl)pyridine-3-sulfonamide?
The IUPAC name of 2-amino-5-bromo-N-(3-cyanophenyl)pyridine-3-sulfonamide (CID 62145031) is 2-amino-5-bromo-N-(3-cyanophenyl)pyridine-3-sulfonamide.
What is the SMILES notation for 2-amino-5-bromo-N-(3-cyanophenyl)pyridine-3-sulfonamide?
The canonical SMILES for 2-amino-5-bromo-N-(3-cyanophenyl)pyridine-3-sulfonamide is N#Cc1cccc(NS(=O)(=O)c2cc(Br)cnc2N)c1.
What is the InChIKey of 2-amino-5-bromo-N-(3-cyanophenyl)pyridine-3-sulfonamide?
The InChIKey is NZRSYTJDMMZOHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9BrN4O2S/c13-9-5-11(12(15)16-7-9)20(18,19)17-10-3-1-2-8(4-10)6-14/h1-5,7,17H,(H2,15,16).
What are the key properties of 2-amino-5-bromo-N-(3-cyanophenyl)pyridine-3-sulfonamide?
2-amino-5-bromo-N-(3-cyanophenyl)pyridine-3-sulfonamide has a molecular weight of 353.20 g/mol, XLogP of 2.10, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-bromo-N-(3-cyanophenyl)pyridine-3-sulfonamide is sourced from PubChem (CID 62145031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).