2-ethoxy-N-[2-(4-sulfamoylphenyl)ethyl]benzamide

C17H20N2O4S — CID 884910

IUPAC2-ethoxy-N-[2-(4-sulfamoylphenyl)ethyl]benzamide
SMILESCCOc1ccccc1C(=O)NCCc1ccc(S(N)(=O)=O)cc1
InChIInChI=1S/C17H20N2O4S/c1-2-23-16-6-4-3-5-15(16)17(20)19-12-11-13-7-9-14(10-8-13)24(18,21)22/h3-10H,2,11-12H2,1H3,(H,19,20)(H2,18,21,22)
InChIKeyZYSHEQHKVQKJEB-UHFFFAOYSA-N
MW348.42 g/mol
LogP1.71
Rot. Bonds7

About 2-ethoxy-N-[2-(4-sulfamoylphenyl)ethyl]benzamide

2-ethoxy-N-[2-(4-sulfamoylphenyl)ethyl]benzamide (PubChem CID 884910) has the molecular formula C17H20N2O4S and a molecular weight of 348.42 g/mol. Its IUPAC name is 2-ethoxy-N-[2-(4-sulfamoylphenyl)ethyl]benzamide.

Molecular Properties

Compound Name2-ethoxy-N-[2-(4-sulfamoylphenyl)ethyl]benzamide
PubChem CID884910
Molecular FormulaC17H20N2O4S
Molecular Weight348.42 g/mol
Exact Mass348.11
IUPAC Name2-ethoxy-N-[2-(4-sulfamoylphenyl)ethyl]benzamide
SMILESCCOc1ccccc1C(=O)NCCc1ccc(S(N)(=O)=O)cc1
InChIInChI=1S/C17H20N2O4S/c1-2-23-16-6-4-3-5-15(16)17(20)19-12-11-13-7-9-14(10-8-13)24(18,21)22/h3-10H,2,11-12H2,1H3,(H,19,20)(H2,18,21,22)
InChIKeyZYSHEQHKVQKJEB-UHFFFAOYSA-N
XLogP1.71
TPSA98.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.42
LogP ≤ 51.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-[2-(4-sulfamoylphenyl)ethyl]benzamide?
The IUPAC name of 2-ethoxy-N-[2-(4-sulfamoylphenyl)ethyl]benzamide (CID 884910) is 2-ethoxy-N-[2-(4-sulfamoylphenyl)ethyl]benzamide.
What is the SMILES notation for 2-ethoxy-N-[2-(4-sulfamoylphenyl)ethyl]benzamide?
The canonical SMILES for 2-ethoxy-N-[2-(4-sulfamoylphenyl)ethyl]benzamide is CCOc1ccccc1C(=O)NCCc1ccc(S(N)(=O)=O)cc1.
What is the InChIKey of 2-ethoxy-N-[2-(4-sulfamoylphenyl)ethyl]benzamide?
The InChIKey is ZYSHEQHKVQKJEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O4S/c1-2-23-16-6-4-3-5-15(16)17(20)19-12-11-13-7-9-14(10-8-13)24(18,21)22/h3-10H,2,11-12H2,1H3,(H,19,20)(H2,18,21,22).
What are the key properties of 2-ethoxy-N-[2-(4-sulfamoylphenyl)ethyl]benzamide?
2-ethoxy-N-[2-(4-sulfamoylphenyl)ethyl]benzamide has a molecular weight of 348.42 g/mol, XLogP of 1.71, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-[2-(4-sulfamoylphenyl)ethyl]benzamide is sourced from PubChem (CID 884910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).