N-(2-methoxyethyl)-4-(2-morpholin-4-ylethylsulfamoyl)benzamide

C16H25N3O5S — CID 109059683

IUPACN-(2-methoxyethyl)-4-(2-morpholin-4-ylethylsulfamoyl)benzamide
SMILESCOCCNC(=O)c1ccc(S(=O)(=O)NCCN2CCOCC2)cc1
InChIInChI=1S/C16H25N3O5S/c1-23-11-7-17-16(20)14-2-4-15(5-3-14)25(21,22)18-6-8-19-9-12-24-13-10-19/h2-5,18H,6-13H2,1H3,(H,17,20)
InChIKeyMPEZNPPIKSZYOI-UHFFFAOYSA-N
MW371.46 g/mol
LogP-0.33
Rot. Bonds9

About N-(2-methoxyethyl)-4-(2-morpholin-4-ylethylsulfamoyl)benzamide

N-(2-methoxyethyl)-4-(2-morpholin-4-ylethylsulfamoyl)benzamide (PubChem CID 109059683) has the molecular formula C16H25N3O5S and a molecular weight of 371.46 g/mol. Its IUPAC name is N-(2-methoxyethyl)-4-(2-morpholin-4-ylethylsulfamoyl)benzamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-4-(2-morpholin-4-ylethylsulfamoyl)benzamide
PubChem CID109059683
Molecular FormulaC16H25N3O5S
Molecular Weight371.46 g/mol
Exact Mass371.15
IUPAC NameN-(2-methoxyethyl)-4-(2-morpholin-4-ylethylsulfamoyl)benzamide
SMILESCOCCNC(=O)c1ccc(S(=O)(=O)NCCN2CCOCC2)cc1
InChIInChI=1S/C16H25N3O5S/c1-23-11-7-17-16(20)14-2-4-15(5-3-14)25(21,22)18-6-8-19-9-12-24-13-10-19/h2-5,18H,6-13H2,1H3,(H,17,20)
InChIKeyMPEZNPPIKSZYOI-UHFFFAOYSA-N
XLogP-0.33
TPSA96.97 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.46
LogP ≤ 5-0.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-4-(2-morpholin-4-ylethylsulfamoyl)benzamide?
The IUPAC name of N-(2-methoxyethyl)-4-(2-morpholin-4-ylethylsulfamoyl)benzamide (CID 109059683) is N-(2-methoxyethyl)-4-(2-morpholin-4-ylethylsulfamoyl)benzamide.
What is the SMILES notation for N-(2-methoxyethyl)-4-(2-morpholin-4-ylethylsulfamoyl)benzamide?
The canonical SMILES for N-(2-methoxyethyl)-4-(2-morpholin-4-ylethylsulfamoyl)benzamide is COCCNC(=O)c1ccc(S(=O)(=O)NCCN2CCOCC2)cc1.
What is the InChIKey of N-(2-methoxyethyl)-4-(2-morpholin-4-ylethylsulfamoyl)benzamide?
The InChIKey is MPEZNPPIKSZYOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O5S/c1-23-11-7-17-16(20)14-2-4-15(5-3-14)25(21,22)18-6-8-19-9-12-24-13-10-19/h2-5,18H,6-13H2,1H3,(H,17,20).
What are the key properties of N-(2-methoxyethyl)-4-(2-morpholin-4-ylethylsulfamoyl)benzamide?
N-(2-methoxyethyl)-4-(2-morpholin-4-ylethylsulfamoyl)benzamide has a molecular weight of 371.46 g/mol, XLogP of -0.33, 9 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-4-(2-morpholin-4-ylethylsulfamoyl)benzamide is sourced from PubChem (CID 109059683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).