2-(piperidine-1-carbonyl)-N-(4-sulfamoylphenyl)benzamide

C19H21N3O4S — CID 646326

IUPAC2-(piperidine-1-carbonyl)-N-(4-sulfamoylphenyl)benzamide
SMILESNS(=O)(=O)c1ccc(NC(=O)c2ccccc2C(=O)N2CCCCC2)cc1
InChIInChI=1S/C19H21N3O4S/c20-27(25,26)15-10-8-14(9-11-15)21-18(23)16-6-2-3-7-17(16)19(24)22-12-4-1-5-13-22/h2-3,6-11H,1,4-5,12-13H2,(H,21,23)(H2,20,25,26)
InChIKeyITKVUKBLNIRQCS-UHFFFAOYSA-N
MW387.46 g/mol
LogP2.21
Rot. Bonds4

About 2-(piperidine-1-carbonyl)-N-(4-sulfamoylphenyl)benzamide

2-(piperidine-1-carbonyl)-N-(4-sulfamoylphenyl)benzamide (PubChem CID 646326) has the molecular formula C19H21N3O4S and a molecular weight of 387.46 g/mol. Its IUPAC name is 2-(piperidine-1-carbonyl)-N-(4-sulfamoylphenyl)benzamide.

Molecular Properties

Compound Name2-(piperidine-1-carbonyl)-N-(4-sulfamoylphenyl)benzamide
PubChem CID646326
Molecular FormulaC19H21N3O4S
Molecular Weight387.46 g/mol
Exact Mass387.13
IUPAC Name2-(piperidine-1-carbonyl)-N-(4-sulfamoylphenyl)benzamide
SMILESNS(=O)(=O)c1ccc(NC(=O)c2ccccc2C(=O)N2CCCCC2)cc1
InChIInChI=1S/C19H21N3O4S/c20-27(25,26)15-10-8-14(9-11-15)21-18(23)16-6-2-3-7-17(16)19(24)22-12-4-1-5-13-22/h2-3,6-11H,1,4-5,12-13H2,(H,21,23)(H2,20,25,26)
InChIKeyITKVUKBLNIRQCS-UHFFFAOYSA-N
XLogP2.21
TPSA109.57 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.46
LogP ≤ 52.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-Sulfamoyl-phenyl)-benzamide
CID 721954
4-(1,3-Dioxo-1,3-dihydro-isoindol-2-YL)-benzenesulfonamide
CID 3586494
N-[4-(Aminosulfonyl)phenyl]-2-mercaptobenzamide
CID 462919
N-(4-(Aminosulfonyl)phenyl)-4-tert-butylbenzamide
CID 315810
N-Benzyl-N-butyl-4-(N-phenylsulfamoyl)benzamide
CID 137796294
4-[(1,4-Dioxo-2-naphthalenyl)amino]benzenesulfonamide
CID 12387471
N-(4-methylphenyl)-3-(piperidin-1-ylcarbonyl)benzenesulfonamide
CID 2361079
N-(4-{[(1-butyrylpiperidin-4-yl)amino]sulfonyl}-1-naphthyl)-2-methylbenzamide
CID 10391001
4-[(3,4-Dioxo-3,4-dihydro-1-naphthalenyl)amino]benzenesulfonamide
CID 367783
N-phenyl-2-(piperidine-1-carbonyl)benzamide
CID 728832
N,N-diethyl-6-oxo-5,6-dihydrophenanthridine-2-sulfonamide
CID 6324455
N-[4-(4-morpholinylsulfonyl)phenyl]benzamide
CID 2811587

Frequently Asked Questions

What is the IUPAC name of 2-(piperidine-1-carbonyl)-N-(4-sulfamoylphenyl)benzamide?
The IUPAC name of 2-(piperidine-1-carbonyl)-N-(4-sulfamoylphenyl)benzamide (CID 646326) is 2-(piperidine-1-carbonyl)-N-(4-sulfamoylphenyl)benzamide.
What is the SMILES notation for 2-(piperidine-1-carbonyl)-N-(4-sulfamoylphenyl)benzamide?
The canonical SMILES for 2-(piperidine-1-carbonyl)-N-(4-sulfamoylphenyl)benzamide is NS(=O)(=O)c1ccc(NC(=O)c2ccccc2C(=O)N2CCCCC2)cc1.
What is the InChIKey of 2-(piperidine-1-carbonyl)-N-(4-sulfamoylphenyl)benzamide?
The InChIKey is ITKVUKBLNIRQCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O4S/c20-27(25,26)15-10-8-14(9-11-15)21-18(23)16-6-2-3-7-17(16)19(24)22-12-4-1-5-13-22/h2-3,6-11H,1,4-5,12-13H2,(H,21,23)(H2,20,25,26).
What are the key properties of 2-(piperidine-1-carbonyl)-N-(4-sulfamoylphenyl)benzamide?
2-(piperidine-1-carbonyl)-N-(4-sulfamoylphenyl)benzamide has a molecular weight of 387.46 g/mol, XLogP of 2.21, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(piperidine-1-carbonyl)-N-(4-sulfamoylphenyl)benzamide is sourced from PubChem (CID 646326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).