N-(5-amino-3-methyl-2-pyridinyl)-2,5-dichlorobenzenesulfonamide

C12H11Cl2N3O2S — CID 115910815

IUPACN-(5-amino-3-methyl-2-pyridinyl)-2,5-dichlorobenzenesulfonamide
SMILESCc1cc(N)cnc1NS(=O)(=O)c1cc(Cl)ccc1Cl
InChIInChI=1S/C12H11Cl2N3O2S/c1-7-4-9(15)6-16-12(7)17-20(18,19)11-5-8(13)2-3-10(11)14/h2-6H,15H2,1H3,(H,16,17)
InChIKeyKNNMENYCRQLBBB-UHFFFAOYSA-N
MW332.21 g/mol
LogP3.08
Rot. Bonds3

About N-(5-amino-3-methyl-2-pyridinyl)-2,5-dichlorobenzenesulfonamide

N-(5-amino-3-methyl-2-pyridinyl)-2,5-dichlorobenzenesulfonamide (PubChem CID 115910815) has the molecular formula C12H11Cl2N3O2S and a molecular weight of 332.21 g/mol. Its IUPAC name is N-(5-amino-3-methyl-2-pyridinyl)-2,5-dichlorobenzenesulfonamide.

Molecular Properties

Compound NameN-(5-amino-3-methyl-2-pyridinyl)-2,5-dichlorobenzenesulfonamide
PubChem CID115910815
Molecular FormulaC12H11Cl2N3O2S
Molecular Weight332.21 g/mol
Exact Mass330.99
IUPAC NameN-(5-amino-3-methyl-2-pyridinyl)-2,5-dichlorobenzenesulfonamide
SMILESCc1cc(N)cnc1NS(=O)(=O)c1cc(Cl)ccc1Cl
InChIInChI=1S/C12H11Cl2N3O2S/c1-7-4-9(15)6-16-12(7)17-20(18,19)11-5-8(13)2-3-10(11)14/h2-6H,15H2,1H3,(H,16,17)
InChIKeyKNNMENYCRQLBBB-UHFFFAOYSA-N
XLogP3.08
TPSA85.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.21
LogP ≤ 53.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(5-amino-3-methyl-2-pyridinyl)-2,5-dichlorobenzenesulfonamide 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

N-(5-amino-3-methyl-2-pyridinyl)-3,4-difluorobenzenesulfonamide
CID 115910794
N-(5-bromo-4-methyl-2-pyridinyl)-2,5-dichlorobenzenesulfonamide
CID 79729132
N-(5-amino-3-methyl-2-pyridinyl)-2,5-dichlorobenzamide
CID 112555309
N-(5-amino-3-methyl-2-pyridinyl)-4-cyano-2-methylbenzenesulfonamide
CID 106996490
N-(5-bromo-3-methyl-2-pyridinyl)-2-chloro-5-fluorobenzenesulfonamide
CID 115731782
N-(5-amino-3-bromo-2-pyridinyl)-2-chloro-5-fluorobenzenesulfonamide
CID 105399568
2,5-dichloro-N-(3-chloropyrazin-2-yl)benzenesulfonamide
CID 102989905
2,5-dichloro-N-(4-methylpyrimidin-2-yl)benzenesulfonamide
CID 2218577
5-amino-N-(5-bromo-3-methyl-2-pyridinyl)-2,3-dimethylbenzenesulfonamide
CID 83165910
2,5-dichloro-N-(5-methyl-1,2-oxazol-3-yl)benzenesulfonamide
CID 717534
2,5-dichloro-N-[3-[(2,5-dichlorophenyl)sulfonylamino]-4-methylphenyl]benzenesulfonamide
CID 4199762
5-amino-2-chloro-N-(5-methyl-2-pyridinyl)benzenesulfonamide
CID 29276222

Frequently Asked Questions

What is the IUPAC name of N-(5-amino-3-methyl-2-pyridinyl)-2,5-dichlorobenzenesulfonamide?
The IUPAC name of N-(5-amino-3-methyl-2-pyridinyl)-2,5-dichlorobenzenesulfonamide (CID 115910815) is N-(5-amino-3-methyl-2-pyridinyl)-2,5-dichlorobenzenesulfonamide.
What is the SMILES notation for N-(5-amino-3-methyl-2-pyridinyl)-2,5-dichlorobenzenesulfonamide?
The canonical SMILES for N-(5-amino-3-methyl-2-pyridinyl)-2,5-dichlorobenzenesulfonamide is Cc1cc(N)cnc1NS(=O)(=O)c1cc(Cl)ccc1Cl.
What is the InChIKey of N-(5-amino-3-methyl-2-pyridinyl)-2,5-dichlorobenzenesulfonamide?
The InChIKey is KNNMENYCRQLBBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11Cl2N3O2S/c1-7-4-9(15)6-16-12(7)17-20(18,19)11-5-8(13)2-3-10(11)14/h2-6H,15H2,1H3,(H,16,17).
What are the key properties of N-(5-amino-3-methyl-2-pyridinyl)-2,5-dichlorobenzenesulfonamide?
N-(5-amino-3-methyl-2-pyridinyl)-2,5-dichlorobenzenesulfonamide has a molecular weight of 332.21 g/mol, XLogP of 3.08, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-amino-3-methyl-2-pyridinyl)-2,5-dichlorobenzenesulfonamide is sourced from PubChem (CID 115910815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).