2,4-dimethoxy-N-[5-(propylamino)-2-pyridinyl]benzenesulfonamide

C16H21N3O4S — CID 113023515

IUPAC2,4-dimethoxy-N-[5-(propylamino)-2-pyridinyl]benzenesulfonamide
SMILESCCCNc1ccc(NS(=O)(=O)c2ccc(OC)cc2OC)nc1
InChIInChI=1S/C16H21N3O4S/c1-4-9-17-12-5-8-16(18-11-12)19-24(20,21)15-7-6-13(22-2)10-14(15)23-3/h5-8,10-11,17H,4,9H2,1-3H3,(H,18,19)
InChIKeyHAXDLINNJIBGEN-UHFFFAOYSA-N
MW351.43 g/mol
LogP2.72
Rot. Bonds8

About 2,4-dimethoxy-N-[5-(propylamino)-2-pyridinyl]benzenesulfonamide

2,4-dimethoxy-N-[5-(propylamino)-2-pyridinyl]benzenesulfonamide (PubChem CID 113023515) has the molecular formula C16H21N3O4S and a molecular weight of 351.43 g/mol. Its IUPAC name is 2,4-dimethoxy-N-[5-(propylamino)-2-pyridinyl]benzenesulfonamide.

Molecular Properties

Compound Name2,4-dimethoxy-N-[5-(propylamino)-2-pyridinyl]benzenesulfonamide
PubChem CID113023515
Molecular FormulaC16H21N3O4S
Molecular Weight351.43 g/mol
Exact Mass351.13
IUPAC Name2,4-dimethoxy-N-[5-(propylamino)-2-pyridinyl]benzenesulfonamide
SMILESCCCNc1ccc(NS(=O)(=O)c2ccc(OC)cc2OC)nc1
InChIInChI=1S/C16H21N3O4S/c1-4-9-17-12-5-8-16(18-11-12)19-24(20,21)15-7-6-13(22-2)10-14(15)23-3/h5-8,10-11,17H,4,9H2,1-3H3,(H,18,19)
InChIKeyHAXDLINNJIBGEN-UHFFFAOYSA-N
XLogP2.72
TPSA89.55 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.43
LogP ≤ 52.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 2,4-dimethoxy-N-[5-(propylamino)-2-pyridinyl]benzenesulfonamide 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

2,4-dimethoxy-N-[4-(propylamino)phenyl]benzenesulfonamide
CID 112979777
N-[5-(cyclopropylamino)-2-pyridinyl]-2,4-dimethoxybenzenesulfonamide
CID 113023785
N-(5-bromo-2-pyridinyl)-2,4-dimethoxybenzenesulfonamide
CID 19683207
N-[6-[2-(dimethylamino)ethylamino]-3-pyridinyl]-2,4-dimethoxybenzenesulfonamide
CID 113010801
N-(2-ethoxypyrimidin-5-yl)-2,4-dimethoxybenzenesulfonamide
CID 122302182
N-[5-(tert-butylamino)-2-pyridinyl]-2,5-dimethoxybenzenesulfonamide
CID 113030058
N-(6-bromo-3-pyridinyl)-2,4-dimethoxybenzenesulfonamide
CID 110605160
N-[6-(cyclohexylamino)-3-pyridinyl]-2,4-dimethoxybenzenesulfonamide
CID 113010132
2,4-dimethoxy-N-(4-methoxyphenyl)benzenesulfonamide
CID 22774026
N-(3,4-dimethylphenyl)-2,4-dimethoxybenzenesulfonamide
CID 19683549
2-chloro-N-[5-(propylamino)-2-pyridinyl]benzenesulfonamide
CID 113023545
N-[6-(2,4-dimethoxyanilino)-3-pyridinyl]propane-1-sulfonamide
CID 113020065

Frequently Asked Questions

What is the IUPAC name of 2,4-dimethoxy-N-[5-(propylamino)-2-pyridinyl]benzenesulfonamide?
The IUPAC name of 2,4-dimethoxy-N-[5-(propylamino)-2-pyridinyl]benzenesulfonamide (CID 113023515) is 2,4-dimethoxy-N-[5-(propylamino)-2-pyridinyl]benzenesulfonamide.
What is the SMILES notation for 2,4-dimethoxy-N-[5-(propylamino)-2-pyridinyl]benzenesulfonamide?
The canonical SMILES for 2,4-dimethoxy-N-[5-(propylamino)-2-pyridinyl]benzenesulfonamide is CCCNc1ccc(NS(=O)(=O)c2ccc(OC)cc2OC)nc1.
What is the InChIKey of 2,4-dimethoxy-N-[5-(propylamino)-2-pyridinyl]benzenesulfonamide?
The InChIKey is HAXDLINNJIBGEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O4S/c1-4-9-17-12-5-8-16(18-11-12)19-24(20,21)15-7-6-13(22-2)10-14(15)23-3/h5-8,10-11,17H,4,9H2,1-3H3,(H,18,19).
What are the key properties of 2,4-dimethoxy-N-[5-(propylamino)-2-pyridinyl]benzenesulfonamide?
2,4-dimethoxy-N-[5-(propylamino)-2-pyridinyl]benzenesulfonamide has a molecular weight of 351.43 g/mol, XLogP of 2.72, 8 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethoxy-N-[5-(propylamino)-2-pyridinyl]benzenesulfonamide is sourced from PubChem (CID 113023515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).