N-phenyl-5-[2-(4-sulfamoylphenyl)ethylamino]pyridine-2-carboxamide

C20H20N4O3S — CID 109193610

IUPACN-phenyl-5-[2-(4-sulfamoylphenyl)ethylamino]pyridine-2-carboxamide
SMILESNS(=O)(=O)c1ccc(CCNc2ccc(C(=O)Nc3ccccc3)nc2)cc1
InChIInChI=1S/C20H20N4O3S/c21-28(26,27)18-9-6-15(7-10-18)12-13-22-17-8-11-19(23-14-17)20(25)24-16-4-2-1-3-5-16/h1-11,14,22H,12-13H2,(H,24,25)(H2,21,26,27)
InChIKeyXPBRXWLHPJPSJT-UHFFFAOYSA-N
MW396.47 g/mol
LogP2.64
Rot. Bonds7

About N-phenyl-5-[2-(4-sulfamoylphenyl)ethylamino]pyridine-2-carboxamide

N-phenyl-5-[2-(4-sulfamoylphenyl)ethylamino]pyridine-2-carboxamide (PubChem CID 109193610) has the molecular formula C20H20N4O3S and a molecular weight of 396.47 g/mol. Its IUPAC name is N-phenyl-5-[2-(4-sulfamoylphenyl)ethylamino]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-phenyl-5-[2-(4-sulfamoylphenyl)ethylamino]pyridine-2-carboxamide
PubChem CID109193610
Molecular FormulaC20H20N4O3S
Molecular Weight396.47 g/mol
Exact Mass396.13
IUPAC NameN-phenyl-5-[2-(4-sulfamoylphenyl)ethylamino]pyridine-2-carboxamide
SMILESNS(=O)(=O)c1ccc(CCNc2ccc(C(=O)Nc3ccccc3)nc2)cc1
InChIInChI=1S/C20H20N4O3S/c21-28(26,27)18-9-6-15(7-10-18)12-13-22-17-8-11-19(23-14-17)20(25)24-16-4-2-1-3-5-16/h1-11,14,22H,12-13H2,(H,24,25)(H2,21,26,27)
InChIKeyXPBRXWLHPJPSJT-UHFFFAOYSA-N
XLogP2.64
TPSA114.18 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500396.47
LogP ≤ 52.64
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

5-[2-(4-fluorophenyl)ethylamino]-N-phenylpyridine-2-carboxamide
CID 109192413
N-[5-[2-(4-sulfamoylphenyl)ethylamino]-2-pyridinyl]benzamide
CID 113028945
5-(butylamino)-N-[2-(4-sulfamoylphenyl)ethyl]pyridine-2-carboxamide
CID 109180864
N-(3-bromophenyl)-5-(2-phenylethylamino)pyridine-2-carboxamide
CID 109191938
methyl 4-[[5-(2-phenylethylamino)pyridine-2-carbonyl]amino]benzoate
CID 109191932
4-[2-[[6-(morpholine-4-carbonyl)-3-pyridinyl]amino]ethyl]benzenesulfonamide
CID 109184599
N-[2-(4-fluorophenyl)ethyl]-5-(2-phenylethylamino)pyridine-2-carboxamide
CID 109191849
N-(4-acetamidophenyl)-5-(3-phenylpropylamino)pyridine-2-carboxamide
CID 109194935
N-(4-fluorophenyl)-5-(2-phenylethylamino)pyrazine-2-carboxamide
CID 109283961
4-[2-[(6-cyano-3-pyridinyl)amino]ethyl]benzenesulfonamide
CID 79834241
5-(2-phenylethylamino)-N-propylpyridine-2-carboxamide
CID 109179079
2,2-dimethyl-N-phenyl-N'-[2-(4-sulfamoylphenyl)ethyl]propanediamide
CID 108965001

Frequently Asked Questions

What is the IUPAC name of N-phenyl-5-[2-(4-sulfamoylphenyl)ethylamino]pyridine-2-carboxamide?
The IUPAC name of N-phenyl-5-[2-(4-sulfamoylphenyl)ethylamino]pyridine-2-carboxamide (CID 109193610) is N-phenyl-5-[2-(4-sulfamoylphenyl)ethylamino]pyridine-2-carboxamide.
What is the SMILES notation for N-phenyl-5-[2-(4-sulfamoylphenyl)ethylamino]pyridine-2-carboxamide?
The canonical SMILES for N-phenyl-5-[2-(4-sulfamoylphenyl)ethylamino]pyridine-2-carboxamide is NS(=O)(=O)c1ccc(CCNc2ccc(C(=O)Nc3ccccc3)nc2)cc1.
What is the InChIKey of N-phenyl-5-[2-(4-sulfamoylphenyl)ethylamino]pyridine-2-carboxamide?
The InChIKey is XPBRXWLHPJPSJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N4O3S/c21-28(26,27)18-9-6-15(7-10-18)12-13-22-17-8-11-19(23-14-17)20(25)24-16-4-2-1-3-5-16/h1-11,14,22H,12-13H2,(H,24,25)(H2,21,26,27).
What are the key properties of N-phenyl-5-[2-(4-sulfamoylphenyl)ethylamino]pyridine-2-carboxamide?
N-phenyl-5-[2-(4-sulfamoylphenyl)ethylamino]pyridine-2-carboxamide has a molecular weight of 396.47 g/mol, XLogP of 2.64, 7 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenyl-5-[2-(4-sulfamoylphenyl)ethylamino]pyridine-2-carboxamide is sourced from PubChem (CID 109193610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).