N-ethyl-4-methoxy-N-(2-oxo-2-pyrrolidin-1-ylethyl)benzenesulfonamide

C15H22N2O4S — CID 2989949

IUPACN-ethyl-4-methoxy-N-(2-oxo-2-pyrrolidin-1-ylethyl)benzenesulfonamide
SMILESCCN(CC(=O)N1CCCC1)S(=O)(=O)c1ccc(OC)cc1
InChIInChI=1S/C15H22N2O4S/c1-3-17(12-15(18)16-10-4-5-11-16)22(19,20)14-8-6-13(21-2)7-9-14/h6-9H,3-5,10-12H2,1-2H3
InChIKeyGHBHPWSPWMKDTB-UHFFFAOYSA-N
MW326.42 g/mol
LogP1.33
Rot. Bonds6

About N-ethyl-4-methoxy-N-(2-oxo-2-pyrrolidin-1-ylethyl)benzenesulfonamide

N-ethyl-4-methoxy-N-(2-oxo-2-pyrrolidin-1-ylethyl)benzenesulfonamide (PubChem CID 2989949) has the molecular formula C15H22N2O4S and a molecular weight of 326.42 g/mol. Its IUPAC name is N-ethyl-4-methoxy-N-(2-oxo-2-pyrrolidin-1-ylethyl)benzenesulfonamide.

Molecular Properties

Compound NameN-ethyl-4-methoxy-N-(2-oxo-2-pyrrolidin-1-ylethyl)benzenesulfonamide
PubChem CID2989949
Molecular FormulaC15H22N2O4S
Molecular Weight326.42 g/mol
Exact Mass326.13
IUPAC NameN-ethyl-4-methoxy-N-(2-oxo-2-pyrrolidin-1-ylethyl)benzenesulfonamide
SMILESCCN(CC(=O)N1CCCC1)S(=O)(=O)c1ccc(OC)cc1
InChIInChI=1S/C15H22N2O4S/c1-3-17(12-15(18)16-10-4-5-11-16)22(19,20)14-8-6-13(21-2)7-9-14/h6-9H,3-5,10-12H2,1-2H3
InChIKeyGHBHPWSPWMKDTB-UHFFFAOYSA-N
XLogP1.33
TPSA66.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.42
LogP ≤ 51.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-methoxy-N-(2-oxo-2-pyrrolidin-1-ylethyl)benzenesulfonamide?
The IUPAC name of N-ethyl-4-methoxy-N-(2-oxo-2-pyrrolidin-1-ylethyl)benzenesulfonamide (CID 2989949) is N-ethyl-4-methoxy-N-(2-oxo-2-pyrrolidin-1-ylethyl)benzenesulfonamide.
What is the SMILES notation for N-ethyl-4-methoxy-N-(2-oxo-2-pyrrolidin-1-ylethyl)benzenesulfonamide?
The canonical SMILES for N-ethyl-4-methoxy-N-(2-oxo-2-pyrrolidin-1-ylethyl)benzenesulfonamide is CCN(CC(=O)N1CCCC1)S(=O)(=O)c1ccc(OC)cc1.
What is the InChIKey of N-ethyl-4-methoxy-N-(2-oxo-2-pyrrolidin-1-ylethyl)benzenesulfonamide?
The InChIKey is GHBHPWSPWMKDTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O4S/c1-3-17(12-15(18)16-10-4-5-11-16)22(19,20)14-8-6-13(21-2)7-9-14/h6-9H,3-5,10-12H2,1-2H3.
What are the key properties of N-ethyl-4-methoxy-N-(2-oxo-2-pyrrolidin-1-ylethyl)benzenesulfonamide?
N-ethyl-4-methoxy-N-(2-oxo-2-pyrrolidin-1-ylethyl)benzenesulfonamide has a molecular weight of 326.42 g/mol, XLogP of 1.33, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-methoxy-N-(2-oxo-2-pyrrolidin-1-ylethyl)benzenesulfonamide is sourced from PubChem (CID 2989949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).