N-methyl-N-[[4-(piperidine-1-carbonyl)phenyl]methyl]benzenesulfonamide

C20H24N2O3S — CID 50946897

IUPACN-methyl-N-[[4-(piperidine-1-carbonyl)phenyl]methyl]benzenesulfonamide
SMILESCN(Cc1ccc(C(=O)N2CCCCC2)cc1)S(=O)(=O)c1ccccc1
InChIInChI=1S/C20H24N2O3S/c1-21(26(24,25)19-8-4-2-5-9-19)16-17-10-12-18(13-11-17)20(23)22-14-6-3-7-15-22/h2,4-5,8-13H,3,6-7,14-16H2,1H3
InChIKeyGJQURPWYKWWXQG-UHFFFAOYSA-N
MW372.49 g/mol
LogP3.13
Rot. Bonds5

About N-methyl-N-[[4-(piperidine-1-carbonyl)phenyl]methyl]benzenesulfonamide

N-methyl-N-[[4-(piperidine-1-carbonyl)phenyl]methyl]benzenesulfonamide (PubChem CID 50946897) has the molecular formula C20H24N2O3S and a molecular weight of 372.49 g/mol. Its IUPAC name is N-methyl-N-[[4-(piperidine-1-carbonyl)phenyl]methyl]benzenesulfonamide.

Molecular Properties

Compound NameN-methyl-N-[[4-(piperidine-1-carbonyl)phenyl]methyl]benzenesulfonamide
PubChem CID50946897
Molecular FormulaC20H24N2O3S
Molecular Weight372.49 g/mol
Exact Mass372.15
IUPAC NameN-methyl-N-[[4-(piperidine-1-carbonyl)phenyl]methyl]benzenesulfonamide
SMILESCN(Cc1ccc(C(=O)N2CCCCC2)cc1)S(=O)(=O)c1ccccc1
InChIInChI=1S/C20H24N2O3S/c1-21(26(24,25)19-8-4-2-5-9-19)16-17-10-12-18(13-11-17)20(23)22-14-6-3-7-15-22/h2,4-5,8-13H,3,6-7,14-16H2,1H3
InChIKeyGJQURPWYKWWXQG-UHFFFAOYSA-N
XLogP3.13
TPSA57.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.49
LogP ≤ 53.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-Flouro-Benzyl)-4-Sulfamoyl-Benzamide
CID 4290
N-benzyl-4-sulfamoylbenzamide
CID 4347
4-(Aminosulfonyl)-N-((4-Fluorophenyl)Methyl)-Benzamide
CID 446237
1-benzyl-4-(2-(N-(4'-(benzylsulfonyl)benzoyl)-N-methylamino)ethyl)piperidine
CID 197239
N-Benzylsaccharin
CID 95841
Isomerase, glucose
CID 1151718
N-[2-(1-benzylpiperidin-4-yl)ethyl]-4-(benzylsulfonyl)-N-methylbenzamide Hydrochloride
CID 197240
Piperidine Derivative 22
CID 10029132
N-cyclohexyl-3-piperidin-1-ylsulfonylbenzamide
CID 1076675
4-(4-Phenylpiperidin-1-yl)carbonylbenzenesulfonamide
CID 135393499
4-[4-[(4-Fluorophenyl)methyl]piperazin-1-yl]carbonylbenzenesulfonamide
CID 135393501
n-Propyl-4-sulfamoylbenzamide
CID 226552

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[[4-(piperidine-1-carbonyl)phenyl]methyl]benzenesulfonamide?
The IUPAC name of N-methyl-N-[[4-(piperidine-1-carbonyl)phenyl]methyl]benzenesulfonamide (CID 50946897) is N-methyl-N-[[4-(piperidine-1-carbonyl)phenyl]methyl]benzenesulfonamide.
What is the SMILES notation for N-methyl-N-[[4-(piperidine-1-carbonyl)phenyl]methyl]benzenesulfonamide?
The canonical SMILES for N-methyl-N-[[4-(piperidine-1-carbonyl)phenyl]methyl]benzenesulfonamide is CN(Cc1ccc(C(=O)N2CCCCC2)cc1)S(=O)(=O)c1ccccc1.
What is the InChIKey of N-methyl-N-[[4-(piperidine-1-carbonyl)phenyl]methyl]benzenesulfonamide?
The InChIKey is GJQURPWYKWWXQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O3S/c1-21(26(24,25)19-8-4-2-5-9-19)16-17-10-12-18(13-11-17)20(23)22-14-6-3-7-15-22/h2,4-5,8-13H,3,6-7,14-16H2,1H3.
What are the key properties of N-methyl-N-[[4-(piperidine-1-carbonyl)phenyl]methyl]benzenesulfonamide?
N-methyl-N-[[4-(piperidine-1-carbonyl)phenyl]methyl]benzenesulfonamide has a molecular weight of 372.49 g/mol, XLogP of 3.13, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[[4-(piperidine-1-carbonyl)phenyl]methyl]benzenesulfonamide is sourced from PubChem (CID 50946897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).