4-[(2-methylphenyl)sulfamoyl]-N-(2-piperidin-1-yl-3-pyridinyl)benzamide

C24H26N4O3S — CID 55981480

IUPAC4-[(2-methylphenyl)sulfamoyl]-N-(2-piperidin-1-yl-3-pyridinyl)benzamide
SMILESCc1ccccc1NS(=O)(=O)c1ccc(C(=O)Nc2cccnc2N2CCCCC2)cc1
InChIInChI=1S/C24H26N4O3S/c1-18-8-3-4-9-21(18)27-32(30,31)20-13-11-19(12-14-20)24(29)26-22-10-7-15-25-23(22)28-16-5-2-6-17-28/h3-4,7-15,27H,2,5-6,16-17H2,1H3,(H,26,29)
InChIKeyPDRKLOSPJIUJDP-UHFFFAOYSA-N
MW450.56 g/mol
LogP4.43
Rot. Bonds6

About 4-[(2-methylphenyl)sulfamoyl]-N-(2-piperidin-1-yl-3-pyridinyl)benzamide

4-[(2-methylphenyl)sulfamoyl]-N-(2-piperidin-1-yl-3-pyridinyl)benzamide (PubChem CID 55981480) has the molecular formula C24H26N4O3S and a molecular weight of 450.56 g/mol. Its IUPAC name is 4-[(2-methylphenyl)sulfamoyl]-N-(2-piperidin-1-yl-3-pyridinyl)benzamide.

Molecular Properties

Compound Name4-[(2-methylphenyl)sulfamoyl]-N-(2-piperidin-1-yl-3-pyridinyl)benzamide
PubChem CID55981480
Molecular FormulaC24H26N4O3S
Molecular Weight450.56 g/mol
Exact Mass450.17
IUPAC Name4-[(2-methylphenyl)sulfamoyl]-N-(2-piperidin-1-yl-3-pyridinyl)benzamide
SMILESCc1ccccc1NS(=O)(=O)c1ccc(C(=O)Nc2cccnc2N2CCCCC2)cc1
InChIInChI=1S/C24H26N4O3S/c1-18-8-3-4-9-21(18)27-32(30,31)20-13-11-19(12-14-20)24(29)26-22-10-7-15-25-23(22)28-16-5-2-6-17-28/h3-4,7-15,27H,2,5-6,16-17H2,1H3,(H,26,29)
InChIKeyPDRKLOSPJIUJDP-UHFFFAOYSA-N
XLogP4.43
TPSA91.40 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500450.56
LogP ≤ 54.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-methylphenyl)-4-[(2-methylphenyl)sulfamoyl]benzamide
CID 9342166
N-[2-(azepan-1-yl)ethyl]-4-[(2-methylphenyl)sulfamoyl]benzamide
CID 37295302
4-[(2-methylphenyl)sulfamoyl]-N-[4-(piperidin-1-ylmethyl)-1,3-thiazol-2-yl]benzamide
CID 26129310
N-[2-(azepan-1-yl)phenyl]-4-(methylsulfamoyl)benzamide
CID 38282895
4-methyl-N-[2-(4-methylpiperazin-1-yl)-3-pyridinyl]benzamide
CID 3730038
4-(benzenesulfonamido)-N-[4-[(2-methylphenyl)sulfamoyl]phenyl]benzamide
CID 17052595
N-[5-(cyclopropanecarbonylamino)-2-methylphenyl]-4-[(2-methylphenyl)sulfamoyl]benzamide
CID 46467572
4-[(2-methylphenyl)sulfamoyl]-N-(2-methyl-2-piperidin-1-ylpropyl)benzamide
CID 17461919
N-methyl-4-[(2-piperidin-1-ylphenyl)sulfamoyl]benzamide
CID 17496437
N-(4-fluorophenyl)-4-[(2-methylphenyl)sulfamoyl]benzamide
CID 9416298
N-(2-methylcyclohexyl)-4-[(2-methylphenyl)sulfamoyl]benzamide
CID 42992273
N-[2-(azepan-1-yl)phenyl]-4-(propan-2-ylsulfamoyl)benzamide
CID 38282657

Frequently Asked Questions

What is the IUPAC name of 4-[(2-methylphenyl)sulfamoyl]-N-(2-piperidin-1-yl-3-pyridinyl)benzamide?
The IUPAC name of 4-[(2-methylphenyl)sulfamoyl]-N-(2-piperidin-1-yl-3-pyridinyl)benzamide (CID 55981480) is 4-[(2-methylphenyl)sulfamoyl]-N-(2-piperidin-1-yl-3-pyridinyl)benzamide.
What is the SMILES notation for 4-[(2-methylphenyl)sulfamoyl]-N-(2-piperidin-1-yl-3-pyridinyl)benzamide?
The canonical SMILES for 4-[(2-methylphenyl)sulfamoyl]-N-(2-piperidin-1-yl-3-pyridinyl)benzamide is Cc1ccccc1NS(=O)(=O)c1ccc(C(=O)Nc2cccnc2N2CCCCC2)cc1.
What is the InChIKey of 4-[(2-methylphenyl)sulfamoyl]-N-(2-piperidin-1-yl-3-pyridinyl)benzamide?
The InChIKey is PDRKLOSPJIUJDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N4O3S/c1-18-8-3-4-9-21(18)27-32(30,31)20-13-11-19(12-14-20)24(29)26-22-10-7-15-25-23(22)28-16-5-2-6-17-28/h3-4,7-15,27H,2,5-6,16-17H2,1H3,(H,26,29).
What are the key properties of 4-[(2-methylphenyl)sulfamoyl]-N-(2-piperidin-1-yl-3-pyridinyl)benzamide?
4-[(2-methylphenyl)sulfamoyl]-N-(2-piperidin-1-yl-3-pyridinyl)benzamide has a molecular weight of 450.56 g/mol, XLogP of 4.43, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-methylphenyl)sulfamoyl]-N-(2-piperidin-1-yl-3-pyridinyl)benzamide is sourced from PubChem (CID 55981480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).