N,N,2-trimethylpropane-1-sulfonamide

C6H15NO2S — CID 12503848

IUPACN,N,2-trimethylpropane-1-sulfonamide
SMILESCC(C)CS(=O)(=O)N(C)C
InChIInChI=1S/C6H15NO2S/c1-6(2)5-10(8,9)7(3)4/h6H,5H2,1-4H3
InChIKeyMXPYSKPNTBRJHD-UHFFFAOYSA-N
MW165.26 g/mol
LogP0.53
Rot. Bonds3

About N,N,2-trimethylpropane-1-sulfonamide

N,N,2-trimethylpropane-1-sulfonamide (PubChem CID 12503848) has the molecular formula C6H15NO2S and a molecular weight of 165.26 g/mol. Its IUPAC name is N,N,2-trimethylpropane-1-sulfonamide.

Molecular Properties

Compound NameN,N,2-trimethylpropane-1-sulfonamide
PubChem CID12503848
Molecular FormulaC6H15NO2S
Molecular Weight165.26 g/mol
Exact Mass165.08
IUPAC NameN,N,2-trimethylpropane-1-sulfonamide
SMILESCC(C)CS(=O)(=O)N(C)C
InChIInChI=1S/C6H15NO2S/c1-6(2)5-10(8,9)7(3)4/h6H,5H2,1-4H3
InChIKeyMXPYSKPNTBRJHD-UHFFFAOYSA-N
XLogP0.53
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.26
LogP ≤ 50.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze N,N,2-trimethylpropane-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,N-Dimethylethanesulfonamide
CID 80644
3-fluoro-N,N-dimethylpropane-1-sulfonamide
CID 126990220
N,N-dimethyl-3-sulfanylpropane-1-sulfonamide
CID 9989913
N,N,2-trimethylpropane-2-sulfonamide
CID 12503847
N-methyl-N-(2-methylpropyl)propane-2-sulfonamide
CID 18343503
Propane-2-sulphonic acid dimethyl amide
CID 18723394
Propane-1-sulfonic acid dimethylamide
CID 18738529
N,N-dimethylbutane-1-sulfonamide
CID 19684365
N,N,3-trimethylbutane-1-sulfonamide
CID 20712477
N,N-dimethylbutane-2-sulfonamide
CID 20813351
N,N-dimethylcyclopropanesulfonamide
CID 53401309
N,N,2,2-tetramethylpropane-1-sulfonamide
CID 58664572

Frequently Asked Questions

What is the IUPAC name of N,N,2-trimethylpropane-1-sulfonamide?
The IUPAC name of N,N,2-trimethylpropane-1-sulfonamide (CID 12503848) is N,N,2-trimethylpropane-1-sulfonamide.
What is the SMILES notation for N,N,2-trimethylpropane-1-sulfonamide?
The canonical SMILES for N,N,2-trimethylpropane-1-sulfonamide is CC(C)CS(=O)(=O)N(C)C.
What is the InChIKey of N,N,2-trimethylpropane-1-sulfonamide?
The InChIKey is MXPYSKPNTBRJHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15NO2S/c1-6(2)5-10(8,9)7(3)4/h6H,5H2,1-4H3.
What are the key properties of N,N,2-trimethylpropane-1-sulfonamide?
N,N,2-trimethylpropane-1-sulfonamide has a molecular weight of 165.26 g/mol, XLogP of 0.53, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,2-trimethylpropane-1-sulfonamide is sourced from PubChem (CID 12503848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).