N-(1-ethyl-4-methylpyrrolidin-3-yl)-2-methylmorpholine-4-sulfonamide

C12H25N3O3S — CID 71871892

IUPACN-(1-ethyl-4-methylpyrrolidin-3-yl)-2-methylmorpholine-4-sulfonamide
SMILESCCN1CC(C)C(NS(=O)(=O)N2CCOC(C)C2)C1
InChIInChI=1S/C12H25N3O3S/c1-4-14-7-10(2)12(9-14)13-19(16,17)15-5-6-18-11(3)8-15/h10-13H,4-9H2,1-3H3
InChIKeyAJXCLEMUDQMPJB-UHFFFAOYSA-N
MW291.42 g/mol
LogP-0.12
Rot. Bonds4

About N-(1-ethyl-4-methylpyrrolidin-3-yl)-2-methylmorpholine-4-sulfonamide

N-(1-ethyl-4-methylpyrrolidin-3-yl)-2-methylmorpholine-4-sulfonamide (PubChem CID 71871892) has the molecular formula C12H25N3O3S and a molecular weight of 291.42 g/mol. Its IUPAC name is N-(1-ethyl-4-methylpyrrolidin-3-yl)-2-methylmorpholine-4-sulfonamide.

Molecular Properties

Compound NameN-(1-ethyl-4-methylpyrrolidin-3-yl)-2-methylmorpholine-4-sulfonamide
PubChem CID71871892
Molecular FormulaC12H25N3O3S
Molecular Weight291.42 g/mol
Exact Mass291.16
IUPAC NameN-(1-ethyl-4-methylpyrrolidin-3-yl)-2-methylmorpholine-4-sulfonamide
SMILESCCN1CC(C)C(NS(=O)(=O)N2CCOC(C)C2)C1
InChIInChI=1S/C12H25N3O3S/c1-4-14-7-10(2)12(9-14)13-19(16,17)15-5-6-18-11(3)8-15/h10-13H,4-9H2,1-3H3
InChIKeyAJXCLEMUDQMPJB-UHFFFAOYSA-N
XLogP-0.12
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.42
LogP ≤ 5-0.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(1-ethyl-4-methylpyrrolidin-3-yl)-2-methylmorpholine-4-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-ethyl-4-methylpyrrolidin-3-yl)-2-methylmorpholine-4-sulfonamide?
The IUPAC name of N-(1-ethyl-4-methylpyrrolidin-3-yl)-2-methylmorpholine-4-sulfonamide (CID 71871892) is N-(1-ethyl-4-methylpyrrolidin-3-yl)-2-methylmorpholine-4-sulfonamide.
What is the SMILES notation for N-(1-ethyl-4-methylpyrrolidin-3-yl)-2-methylmorpholine-4-sulfonamide?
The canonical SMILES for N-(1-ethyl-4-methylpyrrolidin-3-yl)-2-methylmorpholine-4-sulfonamide is CCN1CC(C)C(NS(=O)(=O)N2CCOC(C)C2)C1.
What is the InChIKey of N-(1-ethyl-4-methylpyrrolidin-3-yl)-2-methylmorpholine-4-sulfonamide?
The InChIKey is AJXCLEMUDQMPJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3O3S/c1-4-14-7-10(2)12(9-14)13-19(16,17)15-5-6-18-11(3)8-15/h10-13H,4-9H2,1-3H3.
What are the key properties of N-(1-ethyl-4-methylpyrrolidin-3-yl)-2-methylmorpholine-4-sulfonamide?
N-(1-ethyl-4-methylpyrrolidin-3-yl)-2-methylmorpholine-4-sulfonamide has a molecular weight of 291.42 g/mol, XLogP of -0.12, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethyl-4-methylpyrrolidin-3-yl)-2-methylmorpholine-4-sulfonamide is sourced from PubChem (CID 71871892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).