N-(1-ethyl-4-methylpyrrolidin-3-yl)oxolane-3-sulfonamide

C11H22N2O3S — CID 71871891

IUPACN-(1-ethyl-4-methylpyrrolidin-3-yl)oxolane-3-sulfonamide
SMILESCCN1CC(C)C(NS(=O)(=O)C2CCOC2)C1
InChIInChI=1S/C11H22N2O3S/c1-3-13-6-9(2)11(7-13)12-17(14,15)10-4-5-16-8-10/h9-12H,3-8H2,1-2H3
InChIKeyODHCNDBTWPSSQX-UHFFFAOYSA-N
MW262.37 g/mol
LogP0.03
Rot. Bonds4

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

N-(1-ethyl-4-methylpyrrolidin-3-yl)oxolane-3-sulfonamide (PubChem CID 71871891) has the molecular formula C11H22N2O3S and a molecular weight of 262.37 g/mol. Its IUPAC name is N-(1-ethyl-4-methylpyrrolidin-3-yl)oxolane-3-sulfonamide.

Molecular Properties

Compound NameN-(1-ethyl-4-methylpyrrolidin-3-yl)oxolane-3-sulfonamide
PubChem CID71871891
Molecular FormulaC11H22N2O3S
Molecular Weight262.37 g/mol
Exact Mass262.14
IUPAC NameN-(1-ethyl-4-methylpyrrolidin-3-yl)oxolane-3-sulfonamide
SMILESCCN1CC(C)C(NS(=O)(=O)C2CCOC2)C1
InChIInChI=1S/C11H22N2O3S/c1-3-13-6-9(2)11(7-13)12-17(14,15)10-4-5-16-8-10/h9-12H,3-8H2,1-2H3
InChIKeyODHCNDBTWPSSQX-UHFFFAOYSA-N
XLogP0.03
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.37
LogP ≤ 50.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(1-ethyl-4-methylpyrrolidin-3-yl)oxolane-3-sulfonamide?
The IUPAC name of N-(1-ethyl-4-methylpyrrolidin-3-yl)oxolane-3-sulfonamide (CID 71871891) is N-(1-ethyl-4-methylpyrrolidin-3-yl)oxolane-3-sulfonamide.
What is the SMILES notation for N-(1-ethyl-4-methylpyrrolidin-3-yl)oxolane-3-sulfonamide?
The canonical SMILES for N-(1-ethyl-4-methylpyrrolidin-3-yl)oxolane-3-sulfonamide is CCN1CC(C)C(NS(=O)(=O)C2CCOC2)C1.
What is the InChIKey of N-(1-ethyl-4-methylpyrrolidin-3-yl)oxolane-3-sulfonamide?
The InChIKey is ODHCNDBTWPSSQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O3S/c1-3-13-6-9(2)11(7-13)12-17(14,15)10-4-5-16-8-10/h9-12H,3-8H2,1-2H3.
What are the key properties of N-(1-ethyl-4-methylpyrrolidin-3-yl)oxolane-3-sulfonamide?
N-(1-ethyl-4-methylpyrrolidin-3-yl)oxolane-3-sulfonamide has a molecular weight of 262.37 g/mol, XLogP of 0.03, 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)oxolane-3-sulfonamide is sourced from PubChem (CID 71871891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).