4-amino-N-[2-(ethylamino)-6-(methylamino)-4-pyridinyl]benzenesulfonamide

C14H19N5O2S — CID 19353515

IUPAC4-amino-N-[2-(ethylamino)-6-(methylamino)-4-pyridinyl]benzenesulfonamide
SMILESCCNc1cc(NS(=O)(=O)c2ccc(N)cc2)cc(NC)n1
InChIInChI=1S/C14H19N5O2S/c1-3-17-14-9-11(8-13(16-2)18-14)19-22(20,21)12-6-4-10(15)5-7-12/h4-9H,3,15H2,1-2H3,(H3,16,17,18,19)
InChIKeyPKNBSHXKCVHIEG-UHFFFAOYSA-N
MW321.41 g/mol
LogP1.94
Rot. Bonds6

About 4-amino-N-[2-(ethylamino)-6-(methylamino)-4-pyridinyl]benzenesulfonamide

4-amino-N-[2-(ethylamino)-6-(methylamino)-4-pyridinyl]benzenesulfonamide (PubChem CID 19353515) has the molecular formula C14H19N5O2S and a molecular weight of 321.41 g/mol. Its IUPAC name is 4-amino-N-[2-(ethylamino)-6-(methylamino)-4-pyridinyl]benzenesulfonamide.

Molecular Properties

Compound Name4-amino-N-[2-(ethylamino)-6-(methylamino)-4-pyridinyl]benzenesulfonamide
PubChem CID19353515
Molecular FormulaC14H19N5O2S
Molecular Weight321.41 g/mol
Exact Mass321.13
IUPAC Name4-amino-N-[2-(ethylamino)-6-(methylamino)-4-pyridinyl]benzenesulfonamide
SMILESCCNc1cc(NS(=O)(=O)c2ccc(N)cc2)cc(NC)n1
InChIInChI=1S/C14H19N5O2S/c1-3-17-14-9-11(8-13(16-2)18-14)19-22(20,21)12-6-4-10(15)5-7-12/h4-9H,3,15H2,1-2H3,(H3,16,17,18,19)
InChIKeyPKNBSHXKCVHIEG-UHFFFAOYSA-N
XLogP1.94
TPSA109.14 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.41
LogP ≤ 51.94
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze 4-amino-N-[2-(ethylamino)-6-(methylamino)-4-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

4-N-ethyl-6-N-methylpyrimidine-2,4,6-triamine
CID 80769889
N-[4-[[6-(ethylamino)-2-methylpyrimidin-4-yl]amino]phenyl]-4-iodobenzenesulfonamide
CID 122324445
2-amino-N-[2-(methylamino)-6-(trifluoromethyl)-4-pyridinyl]benzenesulfonamide
CID 140981818
4-amino-N-(4,6-dimethylpyrimidin-2-yl)benzenesulfonamide;sulfuric acid
CID 21393658
Benzenesulfonamide, 4-amino-N-(2,6-dimethyl-4-pyrimidinyl)-, sodium salt (1:1)
CID 66643389
4-amino-N-[4-(4-aminophenyl)sulfonylphenyl]benzenesulfonamide
CID 13052807
4-amino-N-(1-ethyl-2-oxo-4-pyridinyl)benzenesulfonamide
CID 95005289
4-N-ethyl-6-N-methyl-2-propylpyrimidine-4,6-diamine
CID 80946507
4-amino-N-ethylbenzenesulfonamide;molecular hydrogen
CID 143629087
N-[4-[[6-(ethylamino)-2-methylpyrimidin-4-yl]amino]phenyl]-4-phenoxybenzenesulfonamide
CID 122324162
CID 57350054
CID 57350054
4-N-(4-aminophenyl)-6-N-ethyl-2-methylpyrimidine-4,6-diamine
CID 99980348

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-[2-(ethylamino)-6-(methylamino)-4-pyridinyl]benzenesulfonamide?
The IUPAC name of 4-amino-N-[2-(ethylamino)-6-(methylamino)-4-pyridinyl]benzenesulfonamide (CID 19353515) is 4-amino-N-[2-(ethylamino)-6-(methylamino)-4-pyridinyl]benzenesulfonamide.
What is the SMILES notation for 4-amino-N-[2-(ethylamino)-6-(methylamino)-4-pyridinyl]benzenesulfonamide?
The canonical SMILES for 4-amino-N-[2-(ethylamino)-6-(methylamino)-4-pyridinyl]benzenesulfonamide is CCNc1cc(NS(=O)(=O)c2ccc(N)cc2)cc(NC)n1.
What is the InChIKey of 4-amino-N-[2-(ethylamino)-6-(methylamino)-4-pyridinyl]benzenesulfonamide?
The InChIKey is PKNBSHXKCVHIEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N5O2S/c1-3-17-14-9-11(8-13(16-2)18-14)19-22(20,21)12-6-4-10(15)5-7-12/h4-9H,3,15H2,1-2H3,(H3,16,17,18,19).
What are the key properties of 4-amino-N-[2-(ethylamino)-6-(methylamino)-4-pyridinyl]benzenesulfonamide?
4-amino-N-[2-(ethylamino)-6-(methylamino)-4-pyridinyl]benzenesulfonamide has a molecular weight of 321.41 g/mol, XLogP of 1.94, 6 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-[2-(ethylamino)-6-(methylamino)-4-pyridinyl]benzenesulfonamide is sourced from PubChem (CID 19353515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).