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

C19H23N3O5S — CID 2109980

IUPAC2-ethoxy-N-[2-oxo-2-[2-(4-sulfamoylphenyl)ethylamino]ethyl]benzamide
SMILESCCOc1ccccc1C(=O)NCC(=O)NCCc1ccc(S(N)(=O)=O)cc1
InChIInChI=1S/C19H23N3O5S/c1-2-27-17-6-4-3-5-16(17)19(24)22-13-18(23)21-12-11-14-7-9-15(10-8-14)28(20,25)26/h3-10H,2,11-13H2,1H3,(H,21,23)(H,22,24)(H2,20,25,26)
InChIKeyHEEFVZFRPZOZRL-UHFFFAOYSA-N
MW405.48 g/mol
LogP0.82
Rot. Bonds9

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

2-ethoxy-N-[2-oxo-2-[2-(4-sulfamoylphenyl)ethylamino]ethyl]benzamide (PubChem CID 2109980) has the molecular formula C19H23N3O5S and a molecular weight of 405.48 g/mol. Its IUPAC name is 2-ethoxy-N-[2-oxo-2-[2-(4-sulfamoylphenyl)ethylamino]ethyl]benzamide.

Molecular Properties

Compound Name2-ethoxy-N-[2-oxo-2-[2-(4-sulfamoylphenyl)ethylamino]ethyl]benzamide
PubChem CID2109980
Molecular FormulaC19H23N3O5S
Molecular Weight405.48 g/mol
Exact Mass405.14
IUPAC Name2-ethoxy-N-[2-oxo-2-[2-(4-sulfamoylphenyl)ethylamino]ethyl]benzamide
SMILESCCOc1ccccc1C(=O)NCC(=O)NCCc1ccc(S(N)(=O)=O)cc1
InChIInChI=1S/C19H23N3O5S/c1-2-27-17-6-4-3-5-16(17)19(24)22-13-18(23)21-12-11-14-7-9-15(10-8-14)28(20,25)26/h3-10H,2,11-13H2,1H3,(H,21,23)(H,22,24)(H2,20,25,26)
InChIKeyHEEFVZFRPZOZRL-UHFFFAOYSA-N
XLogP0.82
TPSA127.59 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500405.48
LogP ≤ 50.82
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-[2-oxo-2-[2-(4-sulfamoylphenyl)ethylamino]ethyl]benzamide?
The IUPAC name of 2-ethoxy-N-[2-oxo-2-[2-(4-sulfamoylphenyl)ethylamino]ethyl]benzamide (CID 2109980) is 2-ethoxy-N-[2-oxo-2-[2-(4-sulfamoylphenyl)ethylamino]ethyl]benzamide.
What is the SMILES notation for 2-ethoxy-N-[2-oxo-2-[2-(4-sulfamoylphenyl)ethylamino]ethyl]benzamide?
The canonical SMILES for 2-ethoxy-N-[2-oxo-2-[2-(4-sulfamoylphenyl)ethylamino]ethyl]benzamide is CCOc1ccccc1C(=O)NCC(=O)NCCc1ccc(S(N)(=O)=O)cc1.
What is the InChIKey of 2-ethoxy-N-[2-oxo-2-[2-(4-sulfamoylphenyl)ethylamino]ethyl]benzamide?
The InChIKey is HEEFVZFRPZOZRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O5S/c1-2-27-17-6-4-3-5-16(17)19(24)22-13-18(23)21-12-11-14-7-9-15(10-8-14)28(20,25)26/h3-10H,2,11-13H2,1H3,(H,21,23)(H,22,24)(H2,20,25,26).
What are the key properties of 2-ethoxy-N-[2-oxo-2-[2-(4-sulfamoylphenyl)ethylamino]ethyl]benzamide?
2-ethoxy-N-[2-oxo-2-[2-(4-sulfamoylphenyl)ethylamino]ethyl]benzamide has a molecular weight of 405.48 g/mol, XLogP of 0.82, 9 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-[2-oxo-2-[2-(4-sulfamoylphenyl)ethylamino]ethyl]benzamide is sourced from PubChem (CID 2109980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).