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

C19H22N2O4S — CID 1340822

IUPACN-benzyl-N-(2-morpholin-4-yl-2-oxoethyl)benzenesulfonamide
SMILESO=C(CN(Cc1ccccc1)S(=O)(=O)c1ccccc1)N1CCOCC1
InChIInChI=1S/C19H22N2O4S/c22-19(20-11-13-25-14-12-20)16-21(15-17-7-3-1-4-8-17)26(23,24)18-9-5-2-6-10-18/h1-10H,11-16H2
InChIKeyWCWYASKOCCEIIJ-UHFFFAOYSA-N
MW374.46 g/mol
LogP1.74
Rot. Bonds6

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

N-benzyl-N-(2-morpholin-4-yl-2-oxoethyl)benzenesulfonamide (PubChem CID 1340822) has the molecular formula C19H22N2O4S and a molecular weight of 374.46 g/mol. Its IUPAC name is N-benzyl-N-(2-morpholin-4-yl-2-oxoethyl)benzenesulfonamide.

Molecular Properties

Compound NameN-benzyl-N-(2-morpholin-4-yl-2-oxoethyl)benzenesulfonamide
PubChem CID1340822
Molecular FormulaC19H22N2O4S
Molecular Weight374.46 g/mol
Exact Mass374.13
IUPAC NameN-benzyl-N-(2-morpholin-4-yl-2-oxoethyl)benzenesulfonamide
SMILESO=C(CN(Cc1ccccc1)S(=O)(=O)c1ccccc1)N1CCOCC1
InChIInChI=1S/C19H22N2O4S/c22-19(20-11-13-25-14-12-20)16-21(15-17-7-3-1-4-8-17)26(23,24)18-9-5-2-6-10-18/h1-10H,11-16H2
InChIKeyWCWYASKOCCEIIJ-UHFFFAOYSA-N
XLogP1.74
TPSA66.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.46
LogP ≤ 51.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-(2-morpholin-4-yl-2-oxoethyl)benzenesulfonamide?
The IUPAC name of N-benzyl-N-(2-morpholin-4-yl-2-oxoethyl)benzenesulfonamide (CID 1340822) is N-benzyl-N-(2-morpholin-4-yl-2-oxoethyl)benzenesulfonamide.
What is the SMILES notation for N-benzyl-N-(2-morpholin-4-yl-2-oxoethyl)benzenesulfonamide?
The canonical SMILES for N-benzyl-N-(2-morpholin-4-yl-2-oxoethyl)benzenesulfonamide is O=C(CN(Cc1ccccc1)S(=O)(=O)c1ccccc1)N1CCOCC1.
What is the InChIKey of N-benzyl-N-(2-morpholin-4-yl-2-oxoethyl)benzenesulfonamide?
The InChIKey is WCWYASKOCCEIIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O4S/c22-19(20-11-13-25-14-12-20)16-21(15-17-7-3-1-4-8-17)26(23,24)18-9-5-2-6-10-18/h1-10H,11-16H2.
What are the key properties of N-benzyl-N-(2-morpholin-4-yl-2-oxoethyl)benzenesulfonamide?
N-benzyl-N-(2-morpholin-4-yl-2-oxoethyl)benzenesulfonamide has a molecular weight of 374.46 g/mol, XLogP of 1.74, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-(2-morpholin-4-yl-2-oxoethyl)benzenesulfonamide is sourced from PubChem (CID 1340822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).