2-morpholin-4-yl-5-sulfamoyl-N-(thiophen-2-ylmethyl)benzamide

C16H19N3O4S2 — CID 9120204

IUPAC2-morpholin-4-yl-5-sulfamoyl-N-(thiophen-2-ylmethyl)benzamide
SMILESNS(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)NCc2cccs2)c1
InChIInChI=1S/C16H19N3O4S2/c17-25(21,22)13-3-4-15(19-5-7-23-8-6-19)14(10-13)16(20)18-11-12-2-1-9-24-12/h1-4,9-10H,5-8,11H2,(H,18,20)(H2,17,21,22)
InChIKeyZCMXTEKDYPSCJZ-UHFFFAOYSA-N
MW381.48 g/mol
LogP1.16
Rot. Bonds5

About 2-morpholin-4-yl-5-sulfamoyl-N-(thiophen-2-ylmethyl)benzamide

2-morpholin-4-yl-5-sulfamoyl-N-(thiophen-2-ylmethyl)benzamide (PubChem CID 9120204) has the molecular formula C16H19N3O4S2 and a molecular weight of 381.48 g/mol. Its IUPAC name is 2-morpholin-4-yl-5-sulfamoyl-N-(thiophen-2-ylmethyl)benzamide.

Molecular Properties

Compound Name2-morpholin-4-yl-5-sulfamoyl-N-(thiophen-2-ylmethyl)benzamide
PubChem CID9120204
Molecular FormulaC16H19N3O4S2
Molecular Weight381.48 g/mol
Exact Mass381.08
IUPAC Name2-morpholin-4-yl-5-sulfamoyl-N-(thiophen-2-ylmethyl)benzamide
SMILESNS(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)NCc2cccs2)c1
InChIInChI=1S/C16H19N3O4S2/c17-25(21,22)13-3-4-15(19-5-7-23-8-6-19)14(10-13)16(20)18-11-12-2-1-9-24-12/h1-4,9-10H,5-8,11H2,(H,18,20)(H2,17,21,22)
InChIKeyZCMXTEKDYPSCJZ-UHFFFAOYSA-N
XLogP1.16
TPSA101.73 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.48
LogP ≤ 51.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-morpholin-4-yl-5-sulfamoyl-N-(thiophen-2-ylmethyl)benzamide?
The IUPAC name of 2-morpholin-4-yl-5-sulfamoyl-N-(thiophen-2-ylmethyl)benzamide (CID 9120204) is 2-morpholin-4-yl-5-sulfamoyl-N-(thiophen-2-ylmethyl)benzamide.
What is the SMILES notation for 2-morpholin-4-yl-5-sulfamoyl-N-(thiophen-2-ylmethyl)benzamide?
The canonical SMILES for 2-morpholin-4-yl-5-sulfamoyl-N-(thiophen-2-ylmethyl)benzamide is NS(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)NCc2cccs2)c1.
What is the InChIKey of 2-morpholin-4-yl-5-sulfamoyl-N-(thiophen-2-ylmethyl)benzamide?
The InChIKey is ZCMXTEKDYPSCJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O4S2/c17-25(21,22)13-3-4-15(19-5-7-23-8-6-19)14(10-13)16(20)18-11-12-2-1-9-24-12/h1-4,9-10H,5-8,11H2,(H,18,20)(H2,17,21,22).
What are the key properties of 2-morpholin-4-yl-5-sulfamoyl-N-(thiophen-2-ylmethyl)benzamide?
2-morpholin-4-yl-5-sulfamoyl-N-(thiophen-2-ylmethyl)benzamide has a molecular weight of 381.48 g/mol, XLogP of 1.16, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-morpholin-4-yl-5-sulfamoyl-N-(thiophen-2-ylmethyl)benzamide is sourced from PubChem (CID 9120204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).