2-amino-N-[2-oxo-2-[2-(4-sulfamoylphenyl)ethylamino]ethyl]acetamide

C12H18N4O4S — CID 10615166

IUPAC2-amino-N-[2-oxo-2-[2-(4-sulfamoylphenyl)ethylamino]ethyl]acetamide
SMILESNCC(=O)NCC(=O)NCCc1ccc(S(N)(=O)=O)cc1
InChIInChI=1S/C12H18N4O4S/c13-7-11(17)16-8-12(18)15-6-5-9-1-3-10(4-2-9)21(14,19)20/h1-4H,5-8,13H2,(H,15,18)(H,16,17)(H2,14,19,20)
InChIKeyLQFFPNBPFAGMFH-UHFFFAOYSA-N
MW314.37 g/mol
LogP-1.93
Rot. Bonds7

About 2-amino-N-[2-oxo-2-[2-(4-sulfamoylphenyl)ethylamino]ethyl]acetamide

2-amino-N-[2-oxo-2-[2-(4-sulfamoylphenyl)ethylamino]ethyl]acetamide (PubChem CID 10615166) has the molecular formula C12H18N4O4S and a molecular weight of 314.37 g/mol. Its IUPAC name is 2-amino-N-[2-oxo-2-[2-(4-sulfamoylphenyl)ethylamino]ethyl]acetamide.

Molecular Properties

Compound Name2-amino-N-[2-oxo-2-[2-(4-sulfamoylphenyl)ethylamino]ethyl]acetamide
PubChem CID10615166
Molecular FormulaC12H18N4O4S
Molecular Weight314.37 g/mol
Exact Mass314.10
IUPAC Name2-amino-N-[2-oxo-2-[2-(4-sulfamoylphenyl)ethylamino]ethyl]acetamide
SMILESNCC(=O)NCC(=O)NCCc1ccc(S(N)(=O)=O)cc1
InChIInChI=1S/C12H18N4O4S/c13-7-11(17)16-8-12(18)15-6-5-9-1-3-10(4-2-9)21(14,19)20/h1-4H,5-8,13H2,(H,15,18)(H,16,17)(H2,14,19,20)
InChIKeyLQFFPNBPFAGMFH-UHFFFAOYSA-N
XLogP-1.93
TPSA144.38 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.37
LogP ≤ 5-1.93
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-oxo-2-[2-(4-sulfamoylphenyl)ethylamino]ethyl]acetamide?
The IUPAC name of 2-amino-N-[2-oxo-2-[2-(4-sulfamoylphenyl)ethylamino]ethyl]acetamide (CID 10615166) is 2-amino-N-[2-oxo-2-[2-(4-sulfamoylphenyl)ethylamino]ethyl]acetamide.
What is the SMILES notation for 2-amino-N-[2-oxo-2-[2-(4-sulfamoylphenyl)ethylamino]ethyl]acetamide?
The canonical SMILES for 2-amino-N-[2-oxo-2-[2-(4-sulfamoylphenyl)ethylamino]ethyl]acetamide is NCC(=O)NCC(=O)NCCc1ccc(S(N)(=O)=O)cc1.
What is the InChIKey of 2-amino-N-[2-oxo-2-[2-(4-sulfamoylphenyl)ethylamino]ethyl]acetamide?
The InChIKey is LQFFPNBPFAGMFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4O4S/c13-7-11(17)16-8-12(18)15-6-5-9-1-3-10(4-2-9)21(14,19)20/h1-4H,5-8,13H2,(H,15,18)(H,16,17)(H2,14,19,20).
What are the key properties of 2-amino-N-[2-oxo-2-[2-(4-sulfamoylphenyl)ethylamino]ethyl]acetamide?
2-amino-N-[2-oxo-2-[2-(4-sulfamoylphenyl)ethylamino]ethyl]acetamide has a molecular weight of 314.37 g/mol, XLogP of -1.93, 7 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[2-oxo-2-[2-(4-sulfamoylphenyl)ethylamino]ethyl]acetamide is sourced from PubChem (CID 10615166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).