N-(1-hydroxy-4-methylpentan-2-yl)pyrrolidine-1-sulfonamide

C10H22N2O3S — CID 61247379

IUPACN-(1-hydroxy-4-methylpentan-2-yl)pyrrolidine-1-sulfonamide
SMILESCC(C)CC(CO)NS(=O)(=O)N1CCCC1
InChIInChI=1S/C10H22N2O3S/c1-9(2)7-10(8-13)11-16(14,15)12-5-3-4-6-12/h9-11,13H,3-8H2,1-2H3
InChIKeyCUJUQEBIMAZOJJ-UHFFFAOYSA-N
MW250.36 g/mol
LogP0.32
Rot. Bonds6

About N-(1-hydroxy-4-methylpentan-2-yl)pyrrolidine-1-sulfonamide

N-(1-hydroxy-4-methylpentan-2-yl)pyrrolidine-1-sulfonamide (PubChem CID 61247379) has the molecular formula C10H22N2O3S and a molecular weight of 250.36 g/mol. Its IUPAC name is N-(1-hydroxy-4-methylpentan-2-yl)pyrrolidine-1-sulfonamide.

Molecular Properties

Compound NameN-(1-hydroxy-4-methylpentan-2-yl)pyrrolidine-1-sulfonamide
PubChem CID61247379
Molecular FormulaC10H22N2O3S
Molecular Weight250.36 g/mol
Exact Mass250.14
IUPAC NameN-(1-hydroxy-4-methylpentan-2-yl)pyrrolidine-1-sulfonamide
SMILESCC(C)CC(CO)NS(=O)(=O)N1CCCC1
InChIInChI=1S/C10H22N2O3S/c1-9(2)7-10(8-13)11-16(14,15)12-5-3-4-6-12/h9-11,13H,3-8H2,1-2H3
InChIKeyCUJUQEBIMAZOJJ-UHFFFAOYSA-N
XLogP0.32
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 ≤ 50.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(1-hydroxy-4-methylpentan-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-(1-hydroxy-4-methylpentan-2-yl)pyrrolidine-1-sulfonamide?
The IUPAC name of N-(1-hydroxy-4-methylpentan-2-yl)pyrrolidine-1-sulfonamide (CID 61247379) is N-(1-hydroxy-4-methylpentan-2-yl)pyrrolidine-1-sulfonamide.
What is the SMILES notation for N-(1-hydroxy-4-methylpentan-2-yl)pyrrolidine-1-sulfonamide?
The canonical SMILES for N-(1-hydroxy-4-methylpentan-2-yl)pyrrolidine-1-sulfonamide is CC(C)CC(CO)NS(=O)(=O)N1CCCC1.
What is the InChIKey of N-(1-hydroxy-4-methylpentan-2-yl)pyrrolidine-1-sulfonamide?
The InChIKey is CUJUQEBIMAZOJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O3S/c1-9(2)7-10(8-13)11-16(14,15)12-5-3-4-6-12/h9-11,13H,3-8H2,1-2H3.
What are the key properties of N-(1-hydroxy-4-methylpentan-2-yl)pyrrolidine-1-sulfonamide?
N-(1-hydroxy-4-methylpentan-2-yl)pyrrolidine-1-sulfonamide has a molecular weight of 250.36 g/mol, XLogP of 0.32, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-hydroxy-4-methylpentan-2-yl)pyrrolidine-1-sulfonamide is sourced from PubChem (CID 61247379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).