5-iodo-N-(2-sulfamoylethyl)thiophene-3-carboxamide

C7H9IN2O3S2 — CID 78950626

IUPAC5-iodo-N-(2-sulfamoylethyl)thiophene-3-carboxamide
SMILESNS(=O)(=O)CCNC(=O)c1csc(I)c1
InChIInChI=1S/C7H9IN2O3S2/c8-6-3-5(4-14-6)7(11)10-1-2-15(9,12)13/h3-4H,1-2H2,(H,10,11)(H2,9,12,13)
InChIKeyKVXDMJOTGYDDOU-UHFFFAOYSA-N
MW360.20 g/mol
LogP0.37
Rot. Bonds4

About 5-iodo-N-(2-sulfamoylethyl)thiophene-3-carboxamide

5-iodo-N-(2-sulfamoylethyl)thiophene-3-carboxamide (PubChem CID 78950626) has the molecular formula C7H9IN2O3S2 and a molecular weight of 360.20 g/mol. Its IUPAC name is 5-iodo-N-(2-sulfamoylethyl)thiophene-3-carboxamide.

Molecular Properties

Compound Name5-iodo-N-(2-sulfamoylethyl)thiophene-3-carboxamide
PubChem CID78950626
Molecular FormulaC7H9IN2O3S2
Molecular Weight360.20 g/mol
Exact Mass359.91
IUPAC Name5-iodo-N-(2-sulfamoylethyl)thiophene-3-carboxamide
SMILESNS(=O)(=O)CCNC(=O)c1csc(I)c1
InChIInChI=1S/C7H9IN2O3S2/c8-6-3-5(4-14-6)7(11)10-1-2-15(9,12)13/h3-4H,1-2H2,(H,10,11)(H2,9,12,13)
InChIKeyKVXDMJOTGYDDOU-UHFFFAOYSA-N
XLogP0.37
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.20
LogP ≤ 50.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

5-iodo-N-(3-methylsulfonylpropyl)thiophene-3-carboxamide
CID 78949717
N-but-3-ynyl-5-iodothiophene-3-carboxamide
CID 78960026
N-(4-bromobutyl)-5-iodothiophene-3-carboxamide
CID 106845793
N-(3-bromopropyl)-5-iodothiophene-3-carboxamide
CID 79693807
5-iodo-N-[3-(methylamino)-3-oxopropyl]thiophene-3-carboxamide
CID 78949941
N-(3-hydroxybutyl)-5-iodothiophene-3-carboxamide
CID 78995528
N-[2-(cyclopropanecarbonylamino)ethyl]-5-iodothiophene-3-carboxamide
CID 115618086
5-iodo-N-(2-oxopropyl)thiophene-3-carboxamide
CID 79692764
N-(2-sulfamoylethyl)thiadiazole-4-carboxamide
CID 65215862
methyl 4-[(5-iodothiophene-3-carbonyl)amino]butanoate
CID 78950176
5-iodo-N-(1,3-thiazol-5-ylmethyl)thiophene-3-carboxamide
CID 104579050
5-iodo-N-[2-(1,3-thiazol-2-yl)ethyl]thiophene-3-carboxamide
CID 78948417

Frequently Asked Questions

What is the IUPAC name of 5-iodo-N-(2-sulfamoylethyl)thiophene-3-carboxamide?
The IUPAC name of 5-iodo-N-(2-sulfamoylethyl)thiophene-3-carboxamide (CID 78950626) is 5-iodo-N-(2-sulfamoylethyl)thiophene-3-carboxamide.
What is the SMILES notation for 5-iodo-N-(2-sulfamoylethyl)thiophene-3-carboxamide?
The canonical SMILES for 5-iodo-N-(2-sulfamoylethyl)thiophene-3-carboxamide is NS(=O)(=O)CCNC(=O)c1csc(I)c1.
What is the InChIKey of 5-iodo-N-(2-sulfamoylethyl)thiophene-3-carboxamide?
The InChIKey is KVXDMJOTGYDDOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9IN2O3S2/c8-6-3-5(4-14-6)7(11)10-1-2-15(9,12)13/h3-4H,1-2H2,(H,10,11)(H2,9,12,13).
What are the key properties of 5-iodo-N-(2-sulfamoylethyl)thiophene-3-carboxamide?
5-iodo-N-(2-sulfamoylethyl)thiophene-3-carboxamide has a molecular weight of 360.20 g/mol, XLogP of 0.37, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-iodo-N-(2-sulfamoylethyl)thiophene-3-carboxamide is sourced from PubChem (CID 78950626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).