N-(2-methylhexan-2-yl)pyrrolidine-1-sulfonamide

C11H24N2O2S — CID 138623369

IUPACN-(2-methylhexan-2-yl)pyrrolidine-1-sulfonamide
SMILESCCCCC(C)(C)NS(=O)(=O)N1CCCC1
InChIInChI=1S/C11H24N2O2S/c1-4-5-8-11(2,3)12-16(14,15)13-9-6-7-10-13/h12H,4-10H2,1-3H3
InChIKeyGOHIRWFXOJMHMZ-UHFFFAOYSA-N
MW248.39 g/mol
LogP1.89
Rot. Bonds6

About N-(2-methylhexan-2-yl)pyrrolidine-1-sulfonamide

N-(2-methylhexan-2-yl)pyrrolidine-1-sulfonamide (PubChem CID 138623369) has the molecular formula C11H24N2O2S and a molecular weight of 248.39 g/mol. Its IUPAC name is N-(2-methylhexan-2-yl)pyrrolidine-1-sulfonamide.

Molecular Properties

Compound NameN-(2-methylhexan-2-yl)pyrrolidine-1-sulfonamide
PubChem CID138623369
Molecular FormulaC11H24N2O2S
Molecular Weight248.39 g/mol
Exact Mass248.16
IUPAC NameN-(2-methylhexan-2-yl)pyrrolidine-1-sulfonamide
SMILESCCCCC(C)(C)NS(=O)(=O)N1CCCC1
InChIInChI=1S/C11H24N2O2S/c1-4-5-8-11(2,3)12-16(14,15)13-9-6-7-10-13/h12H,4-10H2,1-3H3
InChIKeyGOHIRWFXOJMHMZ-UHFFFAOYSA-N
XLogP1.89
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.39
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(2-methylhexan-2-yl)pyrrolidine-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

Frequently Asked Questions

What is the IUPAC name of N-(2-methylhexan-2-yl)pyrrolidine-1-sulfonamide?
The IUPAC name of N-(2-methylhexan-2-yl)pyrrolidine-1-sulfonamide (CID 138623369) is N-(2-methylhexan-2-yl)pyrrolidine-1-sulfonamide.
What is the SMILES notation for N-(2-methylhexan-2-yl)pyrrolidine-1-sulfonamide?
The canonical SMILES for N-(2-methylhexan-2-yl)pyrrolidine-1-sulfonamide is CCCCC(C)(C)NS(=O)(=O)N1CCCC1.
What is the InChIKey of N-(2-methylhexan-2-yl)pyrrolidine-1-sulfonamide?
The InChIKey is GOHIRWFXOJMHMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O2S/c1-4-5-8-11(2,3)12-16(14,15)13-9-6-7-10-13/h12H,4-10H2,1-3H3.
What are the key properties of N-(2-methylhexan-2-yl)pyrrolidine-1-sulfonamide?
N-(2-methylhexan-2-yl)pyrrolidine-1-sulfonamide has a molecular weight of 248.39 g/mol, XLogP of 1.89, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylhexan-2-yl)pyrrolidine-1-sulfonamide is sourced from PubChem (CID 138623369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).