N-benzyl-4-(2-morpholin-4-yl-2-oxoethoxy)benzenesulfonamide

C19H22N2O5S — CID 1088524

IUPACN-benzyl-4-(2-morpholin-4-yl-2-oxoethoxy)benzenesulfonamide
SMILESO=C(COc1ccc(S(=O)(=O)NCc2ccccc2)cc1)N1CCOCC1
InChIInChI=1S/C19H22N2O5S/c22-19(21-10-12-25-13-11-21)15-26-17-6-8-18(9-7-17)27(23,24)20-14-16-4-2-1-3-5-16/h1-9,20H,10-15H2
InChIKeyRMBYFYSAEBYATL-UHFFFAOYSA-N
MW390.46 g/mol
LogP1.40
Rot. Bonds7

About N-benzyl-4-(2-morpholin-4-yl-2-oxoethoxy)benzenesulfonamide

N-benzyl-4-(2-morpholin-4-yl-2-oxoethoxy)benzenesulfonamide (PubChem CID 1088524) has the molecular formula C19H22N2O5S and a molecular weight of 390.46 g/mol. Its IUPAC name is N-benzyl-4-(2-morpholin-4-yl-2-oxoethoxy)benzenesulfonamide.

Molecular Properties

Compound NameN-benzyl-4-(2-morpholin-4-yl-2-oxoethoxy)benzenesulfonamide
PubChem CID1088524
Molecular FormulaC19H22N2O5S
Molecular Weight390.46 g/mol
Exact Mass390.12
IUPAC NameN-benzyl-4-(2-morpholin-4-yl-2-oxoethoxy)benzenesulfonamide
SMILESO=C(COc1ccc(S(=O)(=O)NCc2ccccc2)cc1)N1CCOCC1
InChIInChI=1S/C19H22N2O5S/c22-19(21-10-12-25-13-11-21)15-26-17-6-8-18(9-7-17)27(23,24)20-14-16-4-2-1-3-5-16/h1-9,20H,10-15H2
InChIKeyRMBYFYSAEBYATL-UHFFFAOYSA-N
XLogP1.40
TPSA84.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.46
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-benzyl-4-(2-morpholin-4-yl-2-oxoethoxy)benzenesulfonamide?
The IUPAC name of N-benzyl-4-(2-morpholin-4-yl-2-oxoethoxy)benzenesulfonamide (CID 1088524) is N-benzyl-4-(2-morpholin-4-yl-2-oxoethoxy)benzenesulfonamide.
What is the SMILES notation for N-benzyl-4-(2-morpholin-4-yl-2-oxoethoxy)benzenesulfonamide?
The canonical SMILES for N-benzyl-4-(2-morpholin-4-yl-2-oxoethoxy)benzenesulfonamide is O=C(COc1ccc(S(=O)(=O)NCc2ccccc2)cc1)N1CCOCC1.
What is the InChIKey of N-benzyl-4-(2-morpholin-4-yl-2-oxoethoxy)benzenesulfonamide?
The InChIKey is RMBYFYSAEBYATL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O5S/c22-19(21-10-12-25-13-11-21)15-26-17-6-8-18(9-7-17)27(23,24)20-14-16-4-2-1-3-5-16/h1-9,20H,10-15H2.
What are the key properties of N-benzyl-4-(2-morpholin-4-yl-2-oxoethoxy)benzenesulfonamide?
N-benzyl-4-(2-morpholin-4-yl-2-oxoethoxy)benzenesulfonamide has a molecular weight of 390.46 g/mol, XLogP of 1.40, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-4-(2-morpholin-4-yl-2-oxoethoxy)benzenesulfonamide is sourced from PubChem (CID 1088524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).