5-(2-aminoethylsulfamoyl)thiophene-3-carboxylic acid

C7H10N2O4S2 — CID 61402682

IUPAC5-(2-aminoethylsulfamoyl)thiophene-3-carboxylic acid
SMILESNCCNS(=O)(=O)c1cc(C(=O)O)cs1
InChIInChI=1S/C7H10N2O4S2/c8-1-2-9-15(12,13)6-3-5(4-14-6)7(10)11/h3-4,9H,1-2,8H2,(H,10,11)
InChIKeyUXOBLQUXMDTYNQ-UHFFFAOYSA-N
MW250.30 g/mol
LogP-0.32
Rot. Bonds5

About 5-(2-aminoethylsulfamoyl)thiophene-3-carboxylic acid

5-(2-aminoethylsulfamoyl)thiophene-3-carboxylic acid (PubChem CID 61402682) has the molecular formula C7H10N2O4S2 and a molecular weight of 250.30 g/mol. Its IUPAC name is 5-(2-aminoethylsulfamoyl)thiophene-3-carboxylic acid.

Molecular Properties

Compound Name5-(2-aminoethylsulfamoyl)thiophene-3-carboxylic acid
PubChem CID61402682
Molecular FormulaC7H10N2O4S2
Molecular Weight250.30 g/mol
Exact Mass250.01
IUPAC Name5-(2-aminoethylsulfamoyl)thiophene-3-carboxylic acid
SMILESNCCNS(=O)(=O)c1cc(C(=O)O)cs1
InChIInChI=1S/C7H10N2O4S2/c8-1-2-9-15(12,13)6-3-5(4-14-6)7(10)11/h3-4,9H,1-2,8H2,(H,10,11)
InChIKeyUXOBLQUXMDTYNQ-UHFFFAOYSA-N
XLogP-0.32
TPSA109.49 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.30
LogP ≤ 5-0.32
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

5-(2-methylpropylsulfamoyl)thiophene-3-carboxylic acid
CID 29033671
5-(3-cyanopropylsulfamoyl)thiophene-3-carboxylic acid
CID 62667746
5-(5,5,5-trifluoropentylsulfamoyl)thiophene-3-carboxylic acid
CID 115515900
5-[[2-(dimethylamino)-2-oxoethyl]sulfamoyl]thiophene-3-carboxylic acid
CID 43214885
5-[(2-amino-2-oxoethoxy)sulfamoyl]thiophene-3-carboxylic acid
CID 112672367
5-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethylsulfamoyl]thiophene-3-carboxylic acid
CID 106414900
5-(thiophen-2-ylmethylsulfamoyl)thiophene-3-carboxylic acid
CID 43242554
5-[2-(2-methylpyrazol-3-yl)ethylsulfamoyl]thiophene-3-carboxylic acid
CID 103004685
5-[(2,2-dimethylcyclopropyl)methylsulfamoyl]thiophene-3-carboxylic acid
CID 114107620
5-(dimethylaminosulfamoyl)thiophene-3-carboxylic acid
CID 83005192
5-[(2-bromophenyl)methylsulfamoyl]thiophene-3-carboxylic acid
CID 61401933
5-[(1-propylcyclopropyl)methylsulfamoyl]thiophene-3-carboxylic acid
CID 114099312

Frequently Asked Questions

What is the IUPAC name of 5-(2-aminoethylsulfamoyl)thiophene-3-carboxylic acid?
The IUPAC name of 5-(2-aminoethylsulfamoyl)thiophene-3-carboxylic acid (CID 61402682) is 5-(2-aminoethylsulfamoyl)thiophene-3-carboxylic acid.
What is the SMILES notation for 5-(2-aminoethylsulfamoyl)thiophene-3-carboxylic acid?
The canonical SMILES for 5-(2-aminoethylsulfamoyl)thiophene-3-carboxylic acid is NCCNS(=O)(=O)c1cc(C(=O)O)cs1.
What is the InChIKey of 5-(2-aminoethylsulfamoyl)thiophene-3-carboxylic acid?
The InChIKey is UXOBLQUXMDTYNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O4S2/c8-1-2-9-15(12,13)6-3-5(4-14-6)7(10)11/h3-4,9H,1-2,8H2,(H,10,11).
What are the key properties of 5-(2-aminoethylsulfamoyl)thiophene-3-carboxylic acid?
5-(2-aminoethylsulfamoyl)thiophene-3-carboxylic acid has a molecular weight of 250.30 g/mol, XLogP of -0.32, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-aminoethylsulfamoyl)thiophene-3-carboxylic acid is sourced from PubChem (CID 61402682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).