N-[2-(5-sulfamoylthiophen-2-yl)ethyl]pyrrolidine-1-carboxamide

C11H17N3O3S2 — CID 113224273

IUPACN-[2-(5-sulfamoylthiophen-2-yl)ethyl]pyrrolidine-1-carboxamide
SMILESNS(=O)(=O)c1ccc(CCNC(=O)N2CCCC2)s1
InChIInChI=1S/C11H17N3O3S2/c12-19(16,17)10-4-3-9(18-10)5-6-13-11(15)14-7-1-2-8-14/h3-4H,1-2,5-8H2,(H,13,15)(H2,12,16,17)
InChIKeyTYWNQPIIPIPECE-UHFFFAOYSA-N
MW303.41 g/mol
LogP0.74
Rot. Bonds4

About N-[2-(5-sulfamoylthiophen-2-yl)ethyl]pyrrolidine-1-carboxamide

N-[2-(5-sulfamoylthiophen-2-yl)ethyl]pyrrolidine-1-carboxamide (PubChem CID 113224273) has the molecular formula C11H17N3O3S2 and a molecular weight of 303.41 g/mol. Its IUPAC name is N-[2-(5-sulfamoylthiophen-2-yl)ethyl]pyrrolidine-1-carboxamide.

Molecular Properties

Compound NameN-[2-(5-sulfamoylthiophen-2-yl)ethyl]pyrrolidine-1-carboxamide
PubChem CID113224273
Molecular FormulaC11H17N3O3S2
Molecular Weight303.41 g/mol
Exact Mass303.07
IUPAC NameN-[2-(5-sulfamoylthiophen-2-yl)ethyl]pyrrolidine-1-carboxamide
SMILESNS(=O)(=O)c1ccc(CCNC(=O)N2CCCC2)s1
InChIInChI=1S/C11H17N3O3S2/c12-19(16,17)10-4-3-9(18-10)5-6-13-11(15)14-7-1-2-8-14/h3-4H,1-2,5-8H2,(H,13,15)(H2,12,16,17)
InChIKeyTYWNQPIIPIPECE-UHFFFAOYSA-N
XLogP0.74
TPSA92.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.41
LogP ≤ 50.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-[2-(azocan-1-yl)-2-oxoethyl]thiophene-2-sulfonamide
CID 60759039
2-cyclohexyl-N-[2-(5-sulfamoylthiophen-2-yl)ethyl]acetamide
CID 43246450
N-[2-(5-sulfamoylthiophen-2-yl)ethyl]butanamide
CID 43133898
N-[2-(5-sulfamoylthiophen-2-yl)ethyl]benzamide
CID 43246441
2-acetamido-N-[2-(5-sulfamoylthiophen-2-yl)ethyl]acetamide
CID 61128464
3-methyl-N-[2-(5-sulfamoylthiophen-2-yl)ethyl]but-2-enamide
CID 61128280
4-hydroxy-N-[2-(5-sulfamoylthiophen-2-yl)ethyl]benzamide
CID 61128277
N-[2-(5-sulfamoylthiophen-2-yl)ethyl]thiane-2-carboxamide
CID 80595560
4-iodo-N-[2-(5-sulfamoylthiophen-2-yl)ethyl]benzamide
CID 43246453
2-methyl-N-[2-(5-sulfamoylthiophen-2-yl)ethyl]thiolane-2-carboxamide
CID 81450580
1,5-dimethyl-N-[2-(5-sulfamoylthiophen-2-yl)ethyl]pyrrole-2-carboxamide
CID 60976637
3-bromo-N-[2-(5-sulfamoylthiophen-2-yl)ethyl]thiophene-2-carboxamide
CID 47286704

Frequently Asked Questions

What is the IUPAC name of N-[2-(5-sulfamoylthiophen-2-yl)ethyl]pyrrolidine-1-carboxamide?
The IUPAC name of N-[2-(5-sulfamoylthiophen-2-yl)ethyl]pyrrolidine-1-carboxamide (CID 113224273) is N-[2-(5-sulfamoylthiophen-2-yl)ethyl]pyrrolidine-1-carboxamide.
What is the SMILES notation for N-[2-(5-sulfamoylthiophen-2-yl)ethyl]pyrrolidine-1-carboxamide?
The canonical SMILES for N-[2-(5-sulfamoylthiophen-2-yl)ethyl]pyrrolidine-1-carboxamide is NS(=O)(=O)c1ccc(CCNC(=O)N2CCCC2)s1.
What is the InChIKey of N-[2-(5-sulfamoylthiophen-2-yl)ethyl]pyrrolidine-1-carboxamide?
The InChIKey is TYWNQPIIPIPECE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O3S2/c12-19(16,17)10-4-3-9(18-10)5-6-13-11(15)14-7-1-2-8-14/h3-4H,1-2,5-8H2,(H,13,15)(H2,12,16,17).
What are the key properties of N-[2-(5-sulfamoylthiophen-2-yl)ethyl]pyrrolidine-1-carboxamide?
N-[2-(5-sulfamoylthiophen-2-yl)ethyl]pyrrolidine-1-carboxamide has a molecular weight of 303.41 g/mol, XLogP of 0.74, 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]pyrrolidine-1-carboxamide is sourced from PubChem (CID 113224273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).