N-(4-methylphenyl)-3-[(4-methylphenyl)sulfonylamino]pyridine-4-carboxamide

C20H19N3O3S — CID 70789421

IUPACN-(4-methylphenyl)-3-[(4-methylphenyl)sulfonylamino]pyridine-4-carboxamide
SMILESCc1ccc(NC(=O)c2ccncc2NS(=O)(=O)c2ccc(C)cc2)cc1
InChIInChI=1S/C20H19N3O3S/c1-14-3-7-16(8-4-14)22-20(24)18-11-12-21-13-19(18)23-27(25,26)17-9-5-15(2)6-10-17/h3-13,23H,1-2H3,(H,22,24)
InChIKeyBMZBXOHSMOFMDO-UHFFFAOYSA-N
MW381.46 g/mol
LogP3.75
Rot. Bonds5

About N-(4-methylphenyl)-3-[(4-methylphenyl)sulfonylamino]pyridine-4-carboxamide

N-(4-methylphenyl)-3-[(4-methylphenyl)sulfonylamino]pyridine-4-carboxamide (PubChem CID 70789421) has the molecular formula C20H19N3O3S and a molecular weight of 381.46 g/mol. Its IUPAC name is N-(4-methylphenyl)-3-[(4-methylphenyl)sulfonylamino]pyridine-4-carboxamide.

Molecular Properties

Compound NameN-(4-methylphenyl)-3-[(4-methylphenyl)sulfonylamino]pyridine-4-carboxamide
PubChem CID70789421
Molecular FormulaC20H19N3O3S
Molecular Weight381.46 g/mol
Exact Mass381.11
IUPAC NameN-(4-methylphenyl)-3-[(4-methylphenyl)sulfonylamino]pyridine-4-carboxamide
SMILESCc1ccc(NC(=O)c2ccncc2NS(=O)(=O)c2ccc(C)cc2)cc1
InChIInChI=1S/C20H19N3O3S/c1-14-3-7-16(8-4-14)22-20(24)18-11-12-21-13-19(18)23-27(25,26)17-9-5-15(2)6-10-17/h3-13,23H,1-2H3,(H,22,24)
InChIKeyBMZBXOHSMOFMDO-UHFFFAOYSA-N
XLogP3.75
TPSA88.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.46
LogP ≤ 53.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-(1H-benzimidazol-2-yl)phenyl]-3-[(4-methylphenyl)sulfonylamino]pyridine-4-carboxamide
CID 70789530
3-[(4-methylphenyl)sulfonylamino]-N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]pyridine-4-carboxamide
CID 70789554
N-(4-iodophenyl)-2-[(4-methylphenyl)sulfonylamino]benzamide
CID 126385456
N-[4-(3,4-dichlorophenyl)-1,3-thiazol-2-yl]-3-[(4-methylphenyl)sulfonylamino]pyridine-4-carboxamide
CID 70789474
4-methyl-N-(3-methyl-4-pyridinyl)benzenesulfonamide
CID 66524316
2-[(4-methylphenyl)sulfonylamino]-N-(6-phenyl-3-pyridinyl)benzamide
CID 70789372
N-(4-methylphenyl)-4-[(4-methylphenyl)sulfamoyl]benzamide
CID 2687815
2-chloro-N-(3,4-dichlorophenyl)-5-[(4-methylphenyl)sulfonylamino]benzamide
CID 46778231
2,4-dichloro-N-[4-[(4-methylphenyl)sulfonylamino]phenyl]benzamide
CID 1053036
2-chloro-N-[4-[(2,4-dichlorophenyl)sulfamoyl]phenyl]-4-[(4-methylphenyl)sulfonylamino]benzamide
CID 43875630
N-[4-(difluoromethoxy)phenyl]-2-[(4-methylphenyl)sulfonylamino]benzamide
CID 4785775
2-chloro-N-[4-[(2,3-dichlorophenyl)sulfamoyl]phenyl]-4-[(4-methylphenyl)sulfonylamino]benzamide
CID 43915574

Frequently Asked Questions

What is the IUPAC name of N-(4-methylphenyl)-3-[(4-methylphenyl)sulfonylamino]pyridine-4-carboxamide?
The IUPAC name of N-(4-methylphenyl)-3-[(4-methylphenyl)sulfonylamino]pyridine-4-carboxamide (CID 70789421) is N-(4-methylphenyl)-3-[(4-methylphenyl)sulfonylamino]pyridine-4-carboxamide.
What is the SMILES notation for N-(4-methylphenyl)-3-[(4-methylphenyl)sulfonylamino]pyridine-4-carboxamide?
The canonical SMILES for N-(4-methylphenyl)-3-[(4-methylphenyl)sulfonylamino]pyridine-4-carboxamide is Cc1ccc(NC(=O)c2ccncc2NS(=O)(=O)c2ccc(C)cc2)cc1.
What is the InChIKey of N-(4-methylphenyl)-3-[(4-methylphenyl)sulfonylamino]pyridine-4-carboxamide?
The InChIKey is BMZBXOHSMOFMDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3O3S/c1-14-3-7-16(8-4-14)22-20(24)18-11-12-21-13-19(18)23-27(25,26)17-9-5-15(2)6-10-17/h3-13,23H,1-2H3,(H,22,24).
What are the key properties of N-(4-methylphenyl)-3-[(4-methylphenyl)sulfonylamino]pyridine-4-carboxamide?
N-(4-methylphenyl)-3-[(4-methylphenyl)sulfonylamino]pyridine-4-carboxamide has a molecular weight of 381.46 g/mol, XLogP of 3.75, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methylphenyl)-3-[(4-methylphenyl)sulfonylamino]pyridine-4-carboxamide is sourced from PubChem (CID 70789421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).