2,4-dimethoxy-N-[2-(4-methylmorpholin-2-yl)ethyl]benzenesulfonamide

C15H24N2O5S — CID 110709979

IUPAC2,4-dimethoxy-N-[2-(4-methylmorpholin-2-yl)ethyl]benzenesulfonamide
SMILESCOc1ccc(S(=O)(=O)NCCC2CN(C)CCO2)c(OC)c1
InChIInChI=1S/C15H24N2O5S/c1-17-8-9-22-13(11-17)6-7-16-23(18,19)15-5-4-12(20-2)10-14(15)21-3/h4-5,10,13,16H,6-9,11H2,1-3H3
InChIKeyRUHYHLBXWSXNKO-UHFFFAOYSA-N
MW344.43 g/mol
LogP0.70
Rot. Bonds7

About 2,4-dimethoxy-N-[2-(4-methylmorpholin-2-yl)ethyl]benzenesulfonamide

2,4-dimethoxy-N-[2-(4-methylmorpholin-2-yl)ethyl]benzenesulfonamide (PubChem CID 110709979) has the molecular formula C15H24N2O5S and a molecular weight of 344.43 g/mol. Its IUPAC name is 2,4-dimethoxy-N-[2-(4-methylmorpholin-2-yl)ethyl]benzenesulfonamide.

Molecular Properties

Compound Name2,4-dimethoxy-N-[2-(4-methylmorpholin-2-yl)ethyl]benzenesulfonamide
PubChem CID110709979
Molecular FormulaC15H24N2O5S
Molecular Weight344.43 g/mol
Exact Mass344.14
IUPAC Name2,4-dimethoxy-N-[2-(4-methylmorpholin-2-yl)ethyl]benzenesulfonamide
SMILESCOc1ccc(S(=O)(=O)NCCC2CN(C)CCO2)c(OC)c1
InChIInChI=1S/C15H24N2O5S/c1-17-8-9-22-13(11-17)6-7-16-23(18,19)15-5-4-12(20-2)10-14(15)21-3/h4-5,10,13,16H,6-9,11H2,1-3H3
InChIKeyRUHYHLBXWSXNKO-UHFFFAOYSA-N
XLogP0.70
TPSA77.10 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.43
LogP ≤ 50.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2,4-dimethoxy-N-[2-(4-methylmorpholin-2-yl)ethyl]benzenesulfonamide?
The IUPAC name of 2,4-dimethoxy-N-[2-(4-methylmorpholin-2-yl)ethyl]benzenesulfonamide (CID 110709979) is 2,4-dimethoxy-N-[2-(4-methylmorpholin-2-yl)ethyl]benzenesulfonamide.
What is the SMILES notation for 2,4-dimethoxy-N-[2-(4-methylmorpholin-2-yl)ethyl]benzenesulfonamide?
The canonical SMILES for 2,4-dimethoxy-N-[2-(4-methylmorpholin-2-yl)ethyl]benzenesulfonamide is COc1ccc(S(=O)(=O)NCCC2CN(C)CCO2)c(OC)c1.
What is the InChIKey of 2,4-dimethoxy-N-[2-(4-methylmorpholin-2-yl)ethyl]benzenesulfonamide?
The InChIKey is RUHYHLBXWSXNKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O5S/c1-17-8-9-22-13(11-17)6-7-16-23(18,19)15-5-4-12(20-2)10-14(15)21-3/h4-5,10,13,16H,6-9,11H2,1-3H3.
What are the key properties of 2,4-dimethoxy-N-[2-(4-methylmorpholin-2-yl)ethyl]benzenesulfonamide?
2,4-dimethoxy-N-[2-(4-methylmorpholin-2-yl)ethyl]benzenesulfonamide has a molecular weight of 344.43 g/mol, XLogP of 0.70, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethoxy-N-[2-(4-methylmorpholin-2-yl)ethyl]benzenesulfonamide is sourced from PubChem (CID 110709979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).