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

C13H14N2O3S2 — CID 43246441

IUPACN-[2-(5-sulfamoylthiophen-2-yl)ethyl]benzamide
SMILESNS(=O)(=O)c1ccc(CCNC(=O)c2ccccc2)s1
InChIInChI=1S/C13H14N2O3S2/c14-20(17,18)12-7-6-11(19-12)8-9-15-13(16)10-4-2-1-3-5-10/h1-7H,8-9H2,(H,15,16)(H2,14,17,18)
InChIKeyDCBMDRARMSXVGQ-UHFFFAOYSA-N
MW310.40 g/mol
LogP1.37
Rot. Bonds5

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

N-[2-(5-sulfamoylthiophen-2-yl)ethyl]benzamide (PubChem CID 43246441) has the molecular formula C13H14N2O3S2 and a molecular weight of 310.40 g/mol. Its IUPAC name is N-[2-(5-sulfamoylthiophen-2-yl)ethyl]benzamide.

Molecular Properties

Compound NameN-[2-(5-sulfamoylthiophen-2-yl)ethyl]benzamide
PubChem CID43246441
Molecular FormulaC13H14N2O3S2
Molecular Weight310.40 g/mol
Exact Mass310.04
IUPAC NameN-[2-(5-sulfamoylthiophen-2-yl)ethyl]benzamide
SMILESNS(=O)(=O)c1ccc(CCNC(=O)c2ccccc2)s1
InChIInChI=1S/C13H14N2O3S2/c14-20(17,18)12-7-6-11(19-12)8-9-15-13(16)10-4-2-1-3-5-10/h1-7H,8-9H2,(H,15,16)(H2,14,17,18)
InChIKeyDCBMDRARMSXVGQ-UHFFFAOYSA-N
XLogP1.37
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.40
LogP ≤ 51.37
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]benzamide?
The IUPAC name of N-[2-(5-sulfamoylthiophen-2-yl)ethyl]benzamide (CID 43246441) is N-[2-(5-sulfamoylthiophen-2-yl)ethyl]benzamide.
What is the SMILES notation for N-[2-(5-sulfamoylthiophen-2-yl)ethyl]benzamide?
The canonical SMILES for N-[2-(5-sulfamoylthiophen-2-yl)ethyl]benzamide is NS(=O)(=O)c1ccc(CCNC(=O)c2ccccc2)s1.
What is the InChIKey of N-[2-(5-sulfamoylthiophen-2-yl)ethyl]benzamide?
The InChIKey is DCBMDRARMSXVGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O3S2/c14-20(17,18)12-7-6-11(19-12)8-9-15-13(16)10-4-2-1-3-5-10/h1-7H,8-9H2,(H,15,16)(H2,14,17,18).
What are the key properties of N-[2-(5-sulfamoylthiophen-2-yl)ethyl]benzamide?
N-[2-(5-sulfamoylthiophen-2-yl)ethyl]benzamide has a molecular weight of 310.40 g/mol, XLogP of 1.37, 5 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]benzamide is sourced from PubChem (CID 43246441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).