N,2-dimethyl-N-pyrrolidin-3-ylpropane-2-sulfonamide

C9H20N2O2S — CID 63689710

IUPACN,2-dimethyl-N-pyrrolidin-3-ylpropane-2-sulfonamide
SMILESCN(C1CCNC1)S(=O)(=O)C(C)(C)C
InChIInChI=1S/C9H20N2O2S/c1-9(2,3)14(12,13)11(4)8-5-6-10-7-8/h8,10H,5-7H2,1-4H3
InChIKeyVVLPSHKPIFHHIY-UHFFFAOYSA-N
MW220.34 g/mol
LogP0.41
Rot. Bonds2

About N,2-dimethyl-N-pyrrolidin-3-ylpropane-2-sulfonamide

N,2-dimethyl-N-pyrrolidin-3-ylpropane-2-sulfonamide (PubChem CID 63689710) has the molecular formula C9H20N2O2S and a molecular weight of 220.34 g/mol. Its IUPAC name is N,2-dimethyl-N-pyrrolidin-3-ylpropane-2-sulfonamide.

Molecular Properties

Compound NameN,2-dimethyl-N-pyrrolidin-3-ylpropane-2-sulfonamide
PubChem CID63689710
Molecular FormulaC9H20N2O2S
Molecular Weight220.34 g/mol
Exact Mass220.12
IUPAC NameN,2-dimethyl-N-pyrrolidin-3-ylpropane-2-sulfonamide
SMILESCN(C1CCNC1)S(=O)(=O)C(C)(C)C
InChIInChI=1S/C9H20N2O2S/c1-9(2,3)14(12,13)11(4)8-5-6-10-7-8/h8,10H,5-7H2,1-4H3
InChIKeyVVLPSHKPIFHHIY-UHFFFAOYSA-N
XLogP0.41
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.34
LogP ≤ 50.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N,2-dimethyl-N-pyrrolidin-3-ylpropane-2-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-[cyclohexyl(methyl)sulfamoyl]-N-methylpyrrolidin-3-amine;hydrochloride
CID 119978613
1-cyclopropyl-N-methyl-N-pyrrolidin-3-ylmethanesulfonamide;hydrochloride
CID 119998770
3-[tert-butylsulfamoyl(methyl)amino]piperidine
CID 114805073
4-fluoro-N-methyl-N-pyrrolidin-3-ylbenzenesulfonamide
CID 60807173
N-methyl-N-piperidin-3-ylmethanesulfonamide
CID 54595457
2,3,4-trifluoro-N-methyl-N-pyrrolidin-3-ylbenzenesulfonamide
CID 55172954
4-chloro-N-methyl-N-pyrrolidin-3-ylbenzenesulfonamide
CID 63298347
1-cyclohexyl-N-methyl-N-pyrrolidin-3-ylmethanesulfonamide;hydrochloride
CID 119978920
N,4-dimethyl-N-pyrrolidin-3-yl-3-(trifluoromethyl)benzenesulfonamide;hydrochloride
CID 119978705
N-methyl-N-[(3R)-piperidin-3-yl]methanesulfonamide;hydrochloride
CID 127263584
2,5-dichloro-N-methyl-N-pyrrolidin-3-ylbenzenesulfonamide
CID 63298034
4-bromo-N-methyl-N-pyrrolidin-3-yl-2-(trifluoromethyl)benzenesulfonamide
CID 119979113

Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-N-pyrrolidin-3-ylpropane-2-sulfonamide?
The IUPAC name of N,2-dimethyl-N-pyrrolidin-3-ylpropane-2-sulfonamide (CID 63689710) is N,2-dimethyl-N-pyrrolidin-3-ylpropane-2-sulfonamide.
What is the SMILES notation for N,2-dimethyl-N-pyrrolidin-3-ylpropane-2-sulfonamide?
The canonical SMILES for N,2-dimethyl-N-pyrrolidin-3-ylpropane-2-sulfonamide is CN(C1CCNC1)S(=O)(=O)C(C)(C)C.
What is the InChIKey of N,2-dimethyl-N-pyrrolidin-3-ylpropane-2-sulfonamide?
The InChIKey is VVLPSHKPIFHHIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O2S/c1-9(2,3)14(12,13)11(4)8-5-6-10-7-8/h8,10H,5-7H2,1-4H3.
What are the key properties of N,2-dimethyl-N-pyrrolidin-3-ylpropane-2-sulfonamide?
N,2-dimethyl-N-pyrrolidin-3-ylpropane-2-sulfonamide has a molecular weight of 220.34 g/mol, XLogP of 0.41, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-N-pyrrolidin-3-ylpropane-2-sulfonamide is sourced from PubChem (CID 63689710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).