N-(2-ethyl-2-hydroxybutyl)pyrrolidine-1-sulfonamide

C10H22N2O3S — CID 65113320

IUPACN-(2-ethyl-2-hydroxybutyl)pyrrolidine-1-sulfonamide
SMILESCCC(O)(CC)CNS(=O)(=O)N1CCCC1
InChIInChI=1S/C10H22N2O3S/c1-3-10(13,4-2)9-11-16(14,15)12-7-5-6-8-12/h11,13H,3-9H2,1-2H3
InChIKeyLAKZBDLFYMURPO-UHFFFAOYSA-N
MW250.36 g/mol
LogP0.47
Rot. Bonds6

About N-(2-ethyl-2-hydroxybutyl)pyrrolidine-1-sulfonamide

N-(2-ethyl-2-hydroxybutyl)pyrrolidine-1-sulfonamide (PubChem CID 65113320) has the molecular formula C10H22N2O3S and a molecular weight of 250.36 g/mol. Its IUPAC name is N-(2-ethyl-2-hydroxybutyl)pyrrolidine-1-sulfonamide.

Molecular Properties

Compound NameN-(2-ethyl-2-hydroxybutyl)pyrrolidine-1-sulfonamide
PubChem CID65113320
Molecular FormulaC10H22N2O3S
Molecular Weight250.36 g/mol
Exact Mass250.14
IUPAC NameN-(2-ethyl-2-hydroxybutyl)pyrrolidine-1-sulfonamide
SMILESCCC(O)(CC)CNS(=O)(=O)N1CCCC1
InChIInChI=1S/C10H22N2O3S/c1-3-10(13,4-2)9-11-16(14,15)12-7-5-6-8-12/h11,13H,3-9H2,1-2H3
InChIKeyLAKZBDLFYMURPO-UHFFFAOYSA-N
XLogP0.47
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.36
LogP ≤ 50.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(2-ethyl-2-hydroxybutyl)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-ethyl-2-hydroxybutyl)pyrrolidine-1-sulfonamide?
The IUPAC name of N-(2-ethyl-2-hydroxybutyl)pyrrolidine-1-sulfonamide (CID 65113320) is N-(2-ethyl-2-hydroxybutyl)pyrrolidine-1-sulfonamide.
What is the SMILES notation for N-(2-ethyl-2-hydroxybutyl)pyrrolidine-1-sulfonamide?
The canonical SMILES for N-(2-ethyl-2-hydroxybutyl)pyrrolidine-1-sulfonamide is CCC(O)(CC)CNS(=O)(=O)N1CCCC1.
What is the InChIKey of N-(2-ethyl-2-hydroxybutyl)pyrrolidine-1-sulfonamide?
The InChIKey is LAKZBDLFYMURPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O3S/c1-3-10(13,4-2)9-11-16(14,15)12-7-5-6-8-12/h11,13H,3-9H2,1-2H3.
What are the key properties of N-(2-ethyl-2-hydroxybutyl)pyrrolidine-1-sulfonamide?
N-(2-ethyl-2-hydroxybutyl)pyrrolidine-1-sulfonamide has a molecular weight of 250.36 g/mol, XLogP of 0.47, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethyl-2-hydroxybutyl)pyrrolidine-1-sulfonamide is sourced from PubChem (CID 65113320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).