N-butyl-N,2-dimethylpiperidine-1-sulfonamide

C11H24N2O2S — CID 128927637

IUPACN-butyl-N,2-dimethylpiperidine-1-sulfonamide
SMILESCCCCN(C)S(=O)(=O)N1CCCCC1C
InChIInChI=1S/C11H24N2O2S/c1-4-5-9-12(3)16(14,15)13-10-7-6-8-11(13)2/h11H,4-10H2,1-3H3
InChIKeyNDNCVMVESJIQML-UHFFFAOYSA-N
MW248.39 g/mol
LogP1.84
Rot. Bonds5

About N-butyl-N,2-dimethylpiperidine-1-sulfonamide

N-butyl-N,2-dimethylpiperidine-1-sulfonamide (PubChem CID 128927637) has the molecular formula C11H24N2O2S and a molecular weight of 248.39 g/mol. Its IUPAC name is N-butyl-N,2-dimethylpiperidine-1-sulfonamide.

Molecular Properties

Compound NameN-butyl-N,2-dimethylpiperidine-1-sulfonamide
PubChem CID128927637
Molecular FormulaC11H24N2O2S
Molecular Weight248.39 g/mol
Exact Mass248.16
IUPAC NameN-butyl-N,2-dimethylpiperidine-1-sulfonamide
SMILESCCCCN(C)S(=O)(=O)N1CCCCC1C
InChIInChI=1S/C11H24N2O2S/c1-4-5-9-12(3)16(14,15)13-10-7-6-8-11(13)2/h11H,4-10H2,1-3H3
InChIKeyNDNCVMVESJIQML-UHFFFAOYSA-N
XLogP1.84
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.39
LogP ≤ 51.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze N-butyl-N,2-dimethylpiperidine-1-sulfonamide 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-hydroxyethyl)-N,2-dimethylpiperidine-1-sulfonamide
CID 60961271
N-ethyl-N,2-dimethylpyrrolidine-1-sulfonamide
CID 130840821
(2R)-1-[butyl(methyl)sulfamoyl]pyrrolidine-2-carboxylic acid
CID 78923008
(2R)-N-butyl-N,2-dimethylpiperazine-1-sulfonamide
CID 82756379
N-(2-hydroxyethyl)-2-methyl-N-propylpiperidine-1-sulfonamide
CID 61425514
N-cyclohexyl-N,2-dimethylpiperidine-1-sulfonamide
CID 128926642
N,N,2-trimethylpyrrolidine-1-sulfonamide
CID 110728214
N-methyl-N-[3-(propan-2-ylamino)propyl]-2-propylpiperidine-1-sulfonamide
CID 83045047
(2R)-N,2-dimethyl-N-(pyridin-4-ylmethyl)piperidine-1-sulfonamide
CID 94812189
N-(3-aminopropyl)-N-cyclopropyl-2-methylpiperidine-1-sulfonamide
CID 43136981
1-[3-hydroxypropyl(methyl)sulfamoyl]piperidine-2-carboxylic acid
CID 114230140
N-(3-aminopropyl)-2-methyl-N-propan-2-ylpiperidine-1-sulfonamide
CID 43136957

Frequently Asked Questions

What is the IUPAC name of N-butyl-N,2-dimethylpiperidine-1-sulfonamide?
The IUPAC name of N-butyl-N,2-dimethylpiperidine-1-sulfonamide (CID 128927637) is N-butyl-N,2-dimethylpiperidine-1-sulfonamide.
What is the SMILES notation for N-butyl-N,2-dimethylpiperidine-1-sulfonamide?
The canonical SMILES for N-butyl-N,2-dimethylpiperidine-1-sulfonamide is CCCCN(C)S(=O)(=O)N1CCCCC1C.
What is the InChIKey of N-butyl-N,2-dimethylpiperidine-1-sulfonamide?
The InChIKey is NDNCVMVESJIQML-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O2S/c1-4-5-9-12(3)16(14,15)13-10-7-6-8-11(13)2/h11H,4-10H2,1-3H3.
What are the key properties of N-butyl-N,2-dimethylpiperidine-1-sulfonamide?
N-butyl-N,2-dimethylpiperidine-1-sulfonamide has a molecular weight of 248.39 g/mol, XLogP of 1.84, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-N,2-dimethylpiperidine-1-sulfonamide is sourced from PubChem (CID 128927637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).