N-(4-chloro-3-pyridin-2-ylphenyl)-6-(2-hydroxyethylamino)-2-methylpyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(3-hydroxypropylsulfamoyl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-morpholin-4-ylbenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-(propylamino)pyridine-4-carboxamide

C83H78Cl4N14O9S — CID 159262944

IUPACN-(4-chloro-3-pyridin-2-ylphenyl)-6-(2-hydroxyethylamino)-2-methylpyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(3-hydroxypropylsulfamoyl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-morpholin-4-ylbenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-(propylamino)pyridine-4-carboxamide
SMILESCCCNc1cc(C(=O)Nc2ccc(Cl)c(-c3ccccn3)c2)ccn1.Cc1nc(NCCO)ccc1C(=O)Nc1ccc(Cl)c(-c2ccccn2)c1.O=C(Nc1ccc(Cl)c(-c2ccccn2)c1)c1ccc(N2CCOCC2)cc1.O=C(Nc1ccc(Cl)c(-c2ccccn2)c1)c1ccc(S(=O)(=O)NCCCO)cc1
InChIInChI=1S/C22H20ClN3O2.C21H20ClN3O4S.C20H19ClN4O2.C20H19ClN4O/c23-20-9-6-17(15-19(20)21-3-1-2-10-24-21)25-22(27)16-4-7-18(8-5-16)26-11-13-28-14-12-26;22-19-10-7-16(14-18(19)20-4-1-2-11-23-20)25-21(27)15-5-8-17(9-6-15)30(28,29)24-12-3-13-26;1-13-15(6-8-19(24-13)23-10-11-26)20(27)25-14-5-7-17(21)16(12-14)18-4-2-3-9-22-18;1-2-9-23-19-12-14(8-11-24-19)20(26)25-15-6-7-17(21)16(13-15)18-5-3-4-10-22-18/h1-10,15H,11-14H2,(H,25,27);1-2,4-11,14,24,26H,3,12-13H2,(H,25,27);2-9,12,26H,10-11H2,1H3,(H,23,24)(H,25,27);3-8,10-13H,2,9H2,1H3,(H,23,24)(H,25,26)
InChIKeyKWSXETURLWJANF-UHFFFAOYSA-N
MW1589.50 g/mol
LogP16.44
Rot. Bonds24

About N-(4-chloro-3-pyridin-2-ylphenyl)-6-(2-hydroxyethylamino)-2-methylpyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(3-hydroxypropylsulfamoyl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-morpholin-4-ylbenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-(propylamino)pyridine-4-carboxamide

N-(4-chloro-3-pyridin-2-ylphenyl)-6-(2-hydroxyethylamino)-2-methylpyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(3-hydroxypropylsulfamoyl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-morpholin-4-ylbenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-(propylamino)pyridine-4-carboxamide (PubChem CID 159262944) has the molecular formula C83H78Cl4N14O9S and a molecular weight of 1589.50 g/mol. Its IUPAC name is N-(4-chloro-3-pyridin-2-ylphenyl)-6-(2-hydroxyethylamino)-2-methylpyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(3-hydroxypropylsulfamoyl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-morpholin-4-ylbenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-(propylamino)pyridine-4-carboxamide.

Molecular Properties

Compound NameN-(4-chloro-3-pyridin-2-ylphenyl)-6-(2-hydroxyethylamino)-2-methylpyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(3-hydroxypropylsulfamoyl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-morpholin-4-ylbenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-(propylamino)pyridine-4-carboxamide
PubChem CID159262944
Molecular FormulaC83H78Cl4N14O9S
Molecular Weight1589.50 g/mol
Exact Mass1586.46
IUPAC NameN-(4-chloro-3-pyridin-2-ylphenyl)-6-(2-hydroxyethylamino)-2-methylpyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(3-hydroxypropylsulfamoyl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-morpholin-4-ylbenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-(propylamino)pyridine-4-carboxamide
SMILESCCCNc1cc(C(=O)Nc2ccc(Cl)c(-c3ccccn3)c2)ccn1.Cc1nc(NCCO)ccc1C(=O)Nc1ccc(Cl)c(-c2ccccn2)c1.O=C(Nc1ccc(Cl)c(-c2ccccn2)c1)c1ccc(N2CCOCC2)cc1.O=C(Nc1ccc(Cl)c(-c2ccccn2)c1)c1ccc(S(=O)(=O)NCCCO)cc1
InChIInChI=1S/C22H20ClN3O2.C21H20ClN3O4S.C20H19ClN4O2.C20H19ClN4O/c23-20-9-6-17(15-19(20)21-3-1-2-10-24-21)25-22(27)16-4-7-18(8-5-16)26-11-13-28-14-12-26;22-19-10-7-16(14-18(19)20-4-1-2-11-23-20)25-21(27)15-5-8-17(9-6-15)30(28,29)24-12-3-13-26;1-13-15(6-8-19(24-13)23-10-11-26)20(27)25-14-5-7-17(21)16(12-14)18-4-2-3-9-22-18;1-2-9-23-19-12-14(8-11-24-19)20(26)25-15-6-7-17(21)16(13-15)18-5-3-4-10-22-18/h1-10,15H,11-14H2,(H,25,27);1-2,4-11,14,24,26H,3,12-13H2,(H,25,27);2-9,12,26H,10-11H2,1H3,(H,23,24)(H,25,27);3-8,10-13H,2,9H2,1H3,(H,23,24)(H,25,26)
InChIKeyKWSXETURLWJANF-UHFFFAOYSA-N
XLogP16.44
TPSA316.90 Ų
H-Bond Donors9
H-Bond Acceptors18
Rotatable Bonds24
Heavy Atoms111
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001589.50
LogP ≤ 516.44
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 1018

Computed Properties (RDKit)

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

Analyze N-(4-chloro-3-pyridin-2-ylphenyl)-6-(2-hydroxyethylamino)-2-methylpyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(3-hydroxypropylsulfamoyl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-morpholin-4-ylbenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-(propylamino)pyridine-4-carboxamide with MolForge

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Related Compounds

N-(4-chloro-3-pyridin-2-ylphenyl)-4-(2-methylsulfonylethylsulfamoyl)benzamide
CID 58614881
N-(4-chloro-3-pyridin-2-ylphenyl)-6-(propylamino)pyridine-3-carboxamide
CID 170126154
N-(4-chloro-3-pyridin-2-ylphenyl)-4-methylbenzamide;formaldehyde;methanol;4-methylmorpholine
CID 143831215
5-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-6-(2-methylpropylamino)pyridine-3-carboxamide;N-[4-chloro-3-(4-ethyl-2-pyridinyl)phenyl]-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-(3-morpholin-4-ylpropylamino)pyridine-3-carboxamide
CID 157054989
N-(4-chloro-3-pyridin-2-ylphenyl)-4-ethylsulfonyl-2-methylbenzamide
CID 58614661
N-(4-chloro-3-pyridin-2-ylphenyl)-2,6-dimethylpyridine-3-carboxamide
CID 45485759
2-chloro-1-N-(4-chloro-3-pyridin-2-ylphenyl)-4-N,4-N-dimethylbenzene-1,4-dicarboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-(3-imidazol-1-ylpropylamino)-2-methylpyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-6-(2-methylpropylamino)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-(morpholine-4-carbonyl)pyridine-3-carboxamide
CID 160682533
6-anilino-N-(4-chloro-3-pyridin-2-ylphenyl)pyridine-3-carboxamide;6-(benzylamino)-N-(4-chloro-3-pyridin-2-ylphenyl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-(2-hydroxyethylamino)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-(2-morpholin-4-ylethylamino)pyridine-3-carboxamide
CID 157182944
N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-6-piperazin-1-ylpyridine-3-carboxamide
CID 58614726
4-[(4-chloro-3-pyridin-2-ylphenyl)carbamoyl]benzoic acid
CID 66877887
N-(4-chloro-3-pyridin-2-ylphenyl)-6-[3-(4,5-dihydroimidazol-1-yl)propylamino]pyridine-3-carboxamide
CID 143198886
N-(4-methyl-3-pyridin-2-ylphenyl)-4-(2,2,2-trifluoroethylsulfamoyl)benzamide
CID 170125944

Frequently Asked Questions

What is the IUPAC name of N-(4-chloro-3-pyridin-2-ylphenyl)-6-(2-hydroxyethylamino)-2-methylpyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(3-hydroxypropylsulfamoyl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-morpholin-4-ylbenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-(propylamino)pyridine-4-carboxamide?
The IUPAC name of N-(4-chloro-3-pyridin-2-ylphenyl)-6-(2-hydroxyethylamino)-2-methylpyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(3-hydroxypropylsulfamoyl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-morpholin-4-ylbenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-(propylamino)pyridine-4-carboxamide (CID 159262944) is N-(4-chloro-3-pyridin-2-ylphenyl)-6-(2-hydroxyethylamino)-2-methylpyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(3-hydroxypropylsulfamoyl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-morpholin-4-ylbenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-(propylamino)pyridine-4-carboxamide.
What is the SMILES notation for N-(4-chloro-3-pyridin-2-ylphenyl)-6-(2-hydroxyethylamino)-2-methylpyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(3-hydroxypropylsulfamoyl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-morpholin-4-ylbenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-(propylamino)pyridine-4-carboxamide?
The canonical SMILES for N-(4-chloro-3-pyridin-2-ylphenyl)-6-(2-hydroxyethylamino)-2-methylpyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(3-hydroxypropylsulfamoyl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-morpholin-4-ylbenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-(propylamino)pyridine-4-carboxamide is CCCNc1cc(C(=O)Nc2ccc(Cl)c(-c3ccccn3)c2)ccn1.Cc1nc(NCCO)ccc1C(=O)Nc1ccc(Cl)c(-c2ccccn2)c1.O=C(Nc1ccc(Cl)c(-c2ccccn2)c1)c1ccc(N2CCOCC2)cc1.O=C(Nc1ccc(Cl)c(-c2ccccn2)c1)c1ccc(S(=O)(=O)NCCCO)cc1.
What is the InChIKey of N-(4-chloro-3-pyridin-2-ylphenyl)-6-(2-hydroxyethylamino)-2-methylpyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(3-hydroxypropylsulfamoyl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-morpholin-4-ylbenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-(propylamino)pyridine-4-carboxamide?
The InChIKey is KWSXETURLWJANF-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20ClN3O2.C21H20ClN3O4S.C20H19ClN4O2.C20H19ClN4O/c23-20-9-6-17(15-19(20)21-3-1-2-10-24-21)25-22(27)16-4-7-18(8-5-16)26-11-13-28-14-12-26;22-19-10-7-16(14-18(19)20-4-1-2-11-23-20)25-21(27)15-5-8-17(9-6-15)30(28,29)24-12-3-13-26;1-13-15(6-8-19(24-13)23-10-11-26)20(27)25-14-5-7-17(21)16(12-14)18-4-2-3-9-22-18;1-2-9-23-19-12-14(8-11-24-19)20(26)25-15-6-7-17(21)16(13-15)18-5-3-4-10-22-18/h1-10,15H,11-14H2,(H,25,27);1-2,4-11,14,24,26H,3,12-13H2,(H,25,27);2-9,12,26H,10-11H2,1H3,(H,23,24)(H,25,27);3-8,10-13H,2,9H2,1H3,(H,23,24)(H,25,26).
What are the key properties of N-(4-chloro-3-pyridin-2-ylphenyl)-6-(2-hydroxyethylamino)-2-methylpyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(3-hydroxypropylsulfamoyl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-morpholin-4-ylbenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-(propylamino)pyridine-4-carboxamide?
N-(4-chloro-3-pyridin-2-ylphenyl)-6-(2-hydroxyethylamino)-2-methylpyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(3-hydroxypropylsulfamoyl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-morpholin-4-ylbenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-(propylamino)pyridine-4-carboxamide has a molecular weight of 1589.50 g/mol, XLogP of 16.44, 24 rotatable bonds, 9 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chloro-3-pyridin-2-ylphenyl)-6-(2-hydroxyethylamino)-2-methylpyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(3-hydroxypropylsulfamoyl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-morpholin-4-ylbenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-(propylamino)pyridine-4-carboxamide is sourced from PubChem (CID 159262944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).