N-[3-[4-(benzenesulfonamido)piperidine-1-carbonyl]phenyl]pyridine-3-carboxamide

C24H24N4O4S — CID 55634720

IUPACN-[3-[4-(benzenesulfonamido)piperidine-1-carbonyl]phenyl]pyridine-3-carboxamide
SMILESO=C(Nc1cccc(C(=O)N2CCC(NS(=O)(=O)c3ccccc3)CC2)c1)c1cccnc1
InChIInChI=1S/C24H24N4O4S/c29-23(19-7-5-13-25-17-19)26-21-8-4-6-18(16-21)24(30)28-14-11-20(12-15-28)27-33(31,32)22-9-2-1-3-10-22/h1-10,13,16-17,20,27H,11-12,14-15H2,(H,26,29)
InChIKeyUFKKWGWFJKFZFL-UHFFFAOYSA-N
MW464.55 g/mol
LogP2.92
Rot. Bonds6

About N-[3-[4-(benzenesulfonamido)piperidine-1-carbonyl]phenyl]pyridine-3-carboxamide

N-[3-[4-(benzenesulfonamido)piperidine-1-carbonyl]phenyl]pyridine-3-carboxamide (PubChem CID 55634720) has the molecular formula C24H24N4O4S and a molecular weight of 464.55 g/mol. Its IUPAC name is N-[3-[4-(benzenesulfonamido)piperidine-1-carbonyl]phenyl]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[3-[4-(benzenesulfonamido)piperidine-1-carbonyl]phenyl]pyridine-3-carboxamide
PubChem CID55634720
Molecular FormulaC24H24N4O4S
Molecular Weight464.55 g/mol
Exact Mass464.15
IUPAC NameN-[3-[4-(benzenesulfonamido)piperidine-1-carbonyl]phenyl]pyridine-3-carboxamide
SMILESO=C(Nc1cccc(C(=O)N2CCC(NS(=O)(=O)c3ccccc3)CC2)c1)c1cccnc1
InChIInChI=1S/C24H24N4O4S/c29-23(19-7-5-13-25-17-19)26-21-8-4-6-18(16-21)24(30)28-14-11-20(12-15-28)27-33(31,32)22-9-2-1-3-10-22/h1-10,13,16-17,20,27H,11-12,14-15H2,(H,26,29)
InChIKeyUFKKWGWFJKFZFL-UHFFFAOYSA-N
XLogP2.92
TPSA108.47 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500464.55
LogP ≤ 52.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[3-[4-(azepane-1-carbonyl)piperidine-1-carbonyl]phenyl]pyridine-3-carboxamide
CID 55633554
N-[3-(4-phenylmethoxypiperidine-1-carbonyl)phenyl]pyridine-3-carboxamide
CID 55633340
N-[1-(3-cyanobenzoyl)piperidin-4-yl]benzenesulfonamide
CID 33161452
N-[3-(3-aminopiperidine-1-carbonyl)phenyl]pyridine-3-carboxamide;dihydrochloride
CID 119381577
3-(cyclopropylsulfamoyl)-N-pyridin-4-ylbenzamide
CID 27700197
N-[1-(2-chloroquinoline-6-carbonyl)piperidin-4-yl]benzenesulfonamide
CID 55731324
N-[3-(4-methylpiperidine-1-carbonyl)phenyl]benzamide
CID 4019473
3-[[3-(cyclohexylsulfamoyl)benzoyl]amino]benzoic acid
CID 1121769
N-[3-(3,9-diazaspiro[5.5]undecane-3-carbonyl)phenyl]pyridine-3-carboxamide;hydrochloride
CID 119047654
(3aS,6aR)-2-[3-(pyridine-3-carbonylamino)benzoyl]-1,3,4,5,6,6a-hexahydrocyclopenta[c]pyrrole-3a-carboxylic acid
CID 120683411
N-[3-[4-(piperidine-1-carbonyl)piperidine-1-carbonyl]phenyl]benzenesulfonamide
CID 55349182
N-[3-(cyclopropanecarbonyl)phenyl]pyridine-3-carboxamide
CID 82122759

Frequently Asked Questions

What is the IUPAC name of N-[3-[4-(benzenesulfonamido)piperidine-1-carbonyl]phenyl]pyridine-3-carboxamide?
The IUPAC name of N-[3-[4-(benzenesulfonamido)piperidine-1-carbonyl]phenyl]pyridine-3-carboxamide (CID 55634720) is N-[3-[4-(benzenesulfonamido)piperidine-1-carbonyl]phenyl]pyridine-3-carboxamide.
What is the SMILES notation for N-[3-[4-(benzenesulfonamido)piperidine-1-carbonyl]phenyl]pyridine-3-carboxamide?
The canonical SMILES for N-[3-[4-(benzenesulfonamido)piperidine-1-carbonyl]phenyl]pyridine-3-carboxamide is O=C(Nc1cccc(C(=O)N2CCC(NS(=O)(=O)c3ccccc3)CC2)c1)c1cccnc1.
What is the InChIKey of N-[3-[4-(benzenesulfonamido)piperidine-1-carbonyl]phenyl]pyridine-3-carboxamide?
The InChIKey is UFKKWGWFJKFZFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N4O4S/c29-23(19-7-5-13-25-17-19)26-21-8-4-6-18(16-21)24(30)28-14-11-20(12-15-28)27-33(31,32)22-9-2-1-3-10-22/h1-10,13,16-17,20,27H,11-12,14-15H2,(H,26,29).
What are the key properties of N-[3-[4-(benzenesulfonamido)piperidine-1-carbonyl]phenyl]pyridine-3-carboxamide?
N-[3-[4-(benzenesulfonamido)piperidine-1-carbonyl]phenyl]pyridine-3-carboxamide has a molecular weight of 464.55 g/mol, XLogP of 2.92, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[4-(benzenesulfonamido)piperidine-1-carbonyl]phenyl]pyridine-3-carboxamide is sourced from PubChem (CID 55634720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).