N-[2-(5-sulfamoylthiophen-2-yl)ethyl]acetamide

C8H12N2O3S2 — CID 43133893

IUPACN-[2-(5-sulfamoylthiophen-2-yl)ethyl]acetamide
SMILESCC(=O)NCCc1ccc(S(N)(=O)=O)s1
InChIInChI=1S/C8H12N2O3S2/c1-6(11)10-5-4-7-2-3-8(14-7)15(9,12)13/h2-3H,4-5H2,1H3,(H,10,11)(H2,9,12,13)
InChIKeyCHQIACJKJNFSLB-UHFFFAOYSA-N
MW248.33 g/mol
LogP0.07
Rot. Bonds4

About N-[2-(5-sulfamoylthiophen-2-yl)ethyl]acetamide

N-[2-(5-sulfamoylthiophen-2-yl)ethyl]acetamide (PubChem CID 43133893) has the molecular formula C8H12N2O3S2 and a molecular weight of 248.33 g/mol. Its IUPAC name is N-[2-(5-sulfamoylthiophen-2-yl)ethyl]acetamide.

Molecular Properties

Compound NameN-[2-(5-sulfamoylthiophen-2-yl)ethyl]acetamide
PubChem CID43133893
Molecular FormulaC8H12N2O3S2
Molecular Weight248.33 g/mol
Exact Mass248.03
IUPAC NameN-[2-(5-sulfamoylthiophen-2-yl)ethyl]acetamide
SMILESCC(=O)NCCc1ccc(S(N)(=O)=O)s1
InChIInChI=1S/C8H12N2O3S2/c1-6(11)10-5-4-7-2-3-8(14-7)15(9,12)13/h2-3H,4-5H2,1H3,(H,10,11)(H2,9,12,13)
InChIKeyCHQIACJKJNFSLB-UHFFFAOYSA-N
XLogP0.07
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 50.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[2-(5-sulfamoylthiophen-2-yl)ethyl]acetamide?
The IUPAC name of N-[2-(5-sulfamoylthiophen-2-yl)ethyl]acetamide (CID 43133893) is N-[2-(5-sulfamoylthiophen-2-yl)ethyl]acetamide.
What is the SMILES notation for N-[2-(5-sulfamoylthiophen-2-yl)ethyl]acetamide?
The canonical SMILES for N-[2-(5-sulfamoylthiophen-2-yl)ethyl]acetamide is CC(=O)NCCc1ccc(S(N)(=O)=O)s1.
What is the InChIKey of N-[2-(5-sulfamoylthiophen-2-yl)ethyl]acetamide?
The InChIKey is CHQIACJKJNFSLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2O3S2/c1-6(11)10-5-4-7-2-3-8(14-7)15(9,12)13/h2-3H,4-5H2,1H3,(H,10,11)(H2,9,12,13).
What are the key properties of N-[2-(5-sulfamoylthiophen-2-yl)ethyl]acetamide?
N-[2-(5-sulfamoylthiophen-2-yl)ethyl]acetamide has a molecular weight of 248.33 g/mol, XLogP of 0.07, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(5-sulfamoylthiophen-2-yl)ethyl]acetamide is sourced from PubChem (CID 43133893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).