N,2-dimethyl-N-(1-methylpiperidin-4-yl)benzenesulfonamide

C14H22N2O2S — CID 57398675

IUPACN,2-dimethyl-N-(1-methylpiperidin-4-yl)benzenesulfonamide
SMILESCc1ccccc1S(=O)(=O)N(C)C1CCN(C)CC1
InChIInChI=1S/C14H22N2O2S/c1-12-6-4-5-7-14(12)19(17,18)16(3)13-8-10-15(2)11-9-13/h4-7,13H,8-11H2,1-3H3
InChIKeyFILDMRSIVMNLJX-UHFFFAOYSA-N
MW282.41 g/mol
LogP1.71
Rot. Bonds3

About N,2-dimethyl-N-(1-methylpiperidin-4-yl)benzenesulfonamide

N,2-dimethyl-N-(1-methylpiperidin-4-yl)benzenesulfonamide (PubChem CID 57398675) has the molecular formula C14H22N2O2S and a molecular weight of 282.41 g/mol. Its IUPAC name is N,2-dimethyl-N-(1-methylpiperidin-4-yl)benzenesulfonamide.

Molecular Properties

Compound NameN,2-dimethyl-N-(1-methylpiperidin-4-yl)benzenesulfonamide
PubChem CID57398675
Molecular FormulaC14H22N2O2S
Molecular Weight282.41 g/mol
Exact Mass282.14
IUPAC NameN,2-dimethyl-N-(1-methylpiperidin-4-yl)benzenesulfonamide
SMILESCc1ccccc1S(=O)(=O)N(C)C1CCN(C)CC1
InChIInChI=1S/C14H22N2O2S/c1-12-6-4-5-7-14(12)19(17,18)16(3)13-8-10-15(2)11-9-13/h4-7,13H,8-11H2,1-3H3
InChIKeyFILDMRSIVMNLJX-UHFFFAOYSA-N
XLogP1.71
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.41
LogP ≤ 51.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze N,2-dimethyl-N-(1-methylpiperidin-4-yl)benzenesulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N,2-dimethyl-N-[[(3R)-1-methylpyrrolidin-3-yl]methyl]benzenesulfonamide
CID 118549662
N-methyl-N-(1-methylpiperidin-4-yl)-2,3-dihydro-1,4-benzodioxine-5-sulfonamide
CID 99130922
N-methyl-N-(1-methylpiperidin-4-yl)-4-phenylbenzenesulfonamide
CID 57398674
3-[methyl-(1-methylpiperidin-4-yl)sulfamoyl]pyridine-2-carbothioamide
CID 106596341
2,6-difluoro-N-methyl-N-(1-methylpiperidin-4-yl)benzenesulfonamide
CID 5184703
2-chloro-N-cyclopropyl-N-methylbenzenesulfonamide
CID 110726799
4-bromo-N-methyl-N-(1-methylpiperidin-4-yl)benzenesulfonamide
CID 60639726
5-amino-N-methyl-N-(1-methylpiperidin-4-yl)-1H-pyrazole-4-sulfonamide
CID 54922416
N-(1-ethylpiperidin-4-yl)-2-hydroxy-N-methylbenzenesulfonamide
CID 81242168
3-chloro-N-methyl-N-(1-methylpiperidin-4-yl)benzenesulfonamide
CID 57395160
N,2-dimethyl-N-[4-(4-methylpiperidin-1-yl)butan-2-yl]benzenesulfonamide
CID 67516363
4-fluoro-3-[methyl-(1-methylpiperidin-4-yl)sulfamoyl]benzoic acid
CID 9160518

Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-N-(1-methylpiperidin-4-yl)benzenesulfonamide?
The IUPAC name of N,2-dimethyl-N-(1-methylpiperidin-4-yl)benzenesulfonamide (CID 57398675) is N,2-dimethyl-N-(1-methylpiperidin-4-yl)benzenesulfonamide.
What is the SMILES notation for N,2-dimethyl-N-(1-methylpiperidin-4-yl)benzenesulfonamide?
The canonical SMILES for N,2-dimethyl-N-(1-methylpiperidin-4-yl)benzenesulfonamide is Cc1ccccc1S(=O)(=O)N(C)C1CCN(C)CC1.
What is the InChIKey of N,2-dimethyl-N-(1-methylpiperidin-4-yl)benzenesulfonamide?
The InChIKey is FILDMRSIVMNLJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2S/c1-12-6-4-5-7-14(12)19(17,18)16(3)13-8-10-15(2)11-9-13/h4-7,13H,8-11H2,1-3H3.
What are the key properties of N,2-dimethyl-N-(1-methylpiperidin-4-yl)benzenesulfonamide?
N,2-dimethyl-N-(1-methylpiperidin-4-yl)benzenesulfonamide has a molecular weight of 282.41 g/mol, XLogP of 1.71, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-N-(1-methylpiperidin-4-yl)benzenesulfonamide is sourced from PubChem (CID 57398675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).