N-ethyl-N-(2-hydroxy-2-methylpropyl)pyrrolidine-3-sulfonamide

C10H22N2O3S — CID 79386205

IUPACN-ethyl-N-(2-hydroxy-2-methylpropyl)pyrrolidine-3-sulfonamide
SMILESCCN(CC(C)(C)O)S(=O)(=O)C1CCNC1
InChIInChI=1S/C10H22N2O3S/c1-4-12(8-10(2,3)13)16(14,15)9-5-6-11-7-9/h9,11,13H,4-8H2,1-3H3
InChIKeyGLYWREIIDXVKGO-UHFFFAOYSA-N
MW250.36 g/mol
LogP-0.23
Rot. Bonds5

About N-ethyl-N-(2-hydroxy-2-methylpropyl)pyrrolidine-3-sulfonamide

N-ethyl-N-(2-hydroxy-2-methylpropyl)pyrrolidine-3-sulfonamide (PubChem CID 79386205) has the molecular formula C10H22N2O3S and a molecular weight of 250.36 g/mol. Its IUPAC name is N-ethyl-N-(2-hydroxy-2-methylpropyl)pyrrolidine-3-sulfonamide.

Molecular Properties

Compound NameN-ethyl-N-(2-hydroxy-2-methylpropyl)pyrrolidine-3-sulfonamide
PubChem CID79386205
Molecular FormulaC10H22N2O3S
Molecular Weight250.36 g/mol
Exact Mass250.14
IUPAC NameN-ethyl-N-(2-hydroxy-2-methylpropyl)pyrrolidine-3-sulfonamide
SMILESCCN(CC(C)(C)O)S(=O)(=O)C1CCNC1
InChIInChI=1S/C10H22N2O3S/c1-4-12(8-10(2,3)13)16(14,15)9-5-6-11-7-9/h9,11,13H,4-8H2,1-3H3
InChIKeyGLYWREIIDXVKGO-UHFFFAOYSA-N
XLogP-0.23
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.36
LogP ≤ 5-0.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(2-hydroxy-2-methylpropyl)pyrrolidine-3-sulfonamide?
The IUPAC name of N-ethyl-N-(2-hydroxy-2-methylpropyl)pyrrolidine-3-sulfonamide (CID 79386205) is N-ethyl-N-(2-hydroxy-2-methylpropyl)pyrrolidine-3-sulfonamide.
What is the SMILES notation for N-ethyl-N-(2-hydroxy-2-methylpropyl)pyrrolidine-3-sulfonamide?
The canonical SMILES for N-ethyl-N-(2-hydroxy-2-methylpropyl)pyrrolidine-3-sulfonamide is CCN(CC(C)(C)O)S(=O)(=O)C1CCNC1.
What is the InChIKey of N-ethyl-N-(2-hydroxy-2-methylpropyl)pyrrolidine-3-sulfonamide?
The InChIKey is GLYWREIIDXVKGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O3S/c1-4-12(8-10(2,3)13)16(14,15)9-5-6-11-7-9/h9,11,13H,4-8H2,1-3H3.
What are the key properties of N-ethyl-N-(2-hydroxy-2-methylpropyl)pyrrolidine-3-sulfonamide?
N-ethyl-N-(2-hydroxy-2-methylpropyl)pyrrolidine-3-sulfonamide has a molecular weight of 250.36 g/mol, XLogP of -0.23, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(2-hydroxy-2-methylpropyl)pyrrolidine-3-sulfonamide is sourced from PubChem (CID 79386205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).