N-(2-cyanoethyl)-N-(2-methoxyethyl)pyrrolidine-1-sulfonamide

C10H19N3O3S — CID 55173259

IUPACN-(2-cyanoethyl)-N-(2-methoxyethyl)pyrrolidine-1-sulfonamide
SMILESCOCCN(CCC#N)S(=O)(=O)N1CCCC1
InChIInChI=1S/C10H19N3O3S/c1-16-10-9-13(8-4-5-11)17(14,15)12-6-2-3-7-12/h2-4,6-10H2,1H3
InChIKeyQCLYBJVDZGGYQX-UHFFFAOYSA-N
MW261.35 g/mol
LogP0.19
Rot. Bonds7

About N-(2-cyanoethyl)-N-(2-methoxyethyl)pyrrolidine-1-sulfonamide

N-(2-cyanoethyl)-N-(2-methoxyethyl)pyrrolidine-1-sulfonamide (PubChem CID 55173259) has the molecular formula C10H19N3O3S and a molecular weight of 261.35 g/mol. Its IUPAC name is N-(2-cyanoethyl)-N-(2-methoxyethyl)pyrrolidine-1-sulfonamide.

Molecular Properties

Compound NameN-(2-cyanoethyl)-N-(2-methoxyethyl)pyrrolidine-1-sulfonamide
PubChem CID55173259
Molecular FormulaC10H19N3O3S
Molecular Weight261.35 g/mol
Exact Mass261.11
IUPAC NameN-(2-cyanoethyl)-N-(2-methoxyethyl)pyrrolidine-1-sulfonamide
SMILESCOCCN(CCC#N)S(=O)(=O)N1CCCC1
InChIInChI=1S/C10H19N3O3S/c1-16-10-9-13(8-4-5-11)17(14,15)12-6-2-3-7-12/h2-4,6-10H2,1H3
InChIKeyQCLYBJVDZGGYQX-UHFFFAOYSA-N
XLogP0.19
TPSA73.64 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.35
LogP ≤ 50.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze N-(2-cyanoethyl)-N-(2-methoxyethyl)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-cyanoethyl)-N-(2-methoxyethyl)pyrrolidine-1-sulfonamide?
The IUPAC name of N-(2-cyanoethyl)-N-(2-methoxyethyl)pyrrolidine-1-sulfonamide (CID 55173259) is N-(2-cyanoethyl)-N-(2-methoxyethyl)pyrrolidine-1-sulfonamide.
What is the SMILES notation for N-(2-cyanoethyl)-N-(2-methoxyethyl)pyrrolidine-1-sulfonamide?
The canonical SMILES for N-(2-cyanoethyl)-N-(2-methoxyethyl)pyrrolidine-1-sulfonamide is COCCN(CCC#N)S(=O)(=O)N1CCCC1.
What is the InChIKey of N-(2-cyanoethyl)-N-(2-methoxyethyl)pyrrolidine-1-sulfonamide?
The InChIKey is QCLYBJVDZGGYQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O3S/c1-16-10-9-13(8-4-5-11)17(14,15)12-6-2-3-7-12/h2-4,6-10H2,1H3.
What are the key properties of N-(2-cyanoethyl)-N-(2-methoxyethyl)pyrrolidine-1-sulfonamide?
N-(2-cyanoethyl)-N-(2-methoxyethyl)pyrrolidine-1-sulfonamide has a molecular weight of 261.35 g/mol, XLogP of 0.19, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyanoethyl)-N-(2-methoxyethyl)pyrrolidine-1-sulfonamide is sourced from PubChem (CID 55173259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).