4-amino-1-ethyl-N-(2-sulfamoylphenyl)pyrrole-2-carboxamide

C13H16N4O3S — CID 61128385

IUPAC4-amino-1-ethyl-N-(2-sulfamoylphenyl)pyrrole-2-carboxamide
SMILESCCn1cc(N)cc1C(=O)Nc1ccccc1S(N)(=O)=O
InChIInChI=1S/C13H16N4O3S/c1-2-17-8-9(14)7-11(17)13(18)16-10-5-3-4-6-12(10)21(15,19)20/h3-8H,2,14H2,1H3,(H,16,18)(H2,15,19,20)
InChIKeyDBLGQWGIAQFASI-UHFFFAOYSA-N
MW308.36 g/mol
LogP0.99
Rot. Bonds4

About 4-amino-1-ethyl-N-(2-sulfamoylphenyl)pyrrole-2-carboxamide

4-amino-1-ethyl-N-(2-sulfamoylphenyl)pyrrole-2-carboxamide (PubChem CID 61128385) has the molecular formula C13H16N4O3S and a molecular weight of 308.36 g/mol. Its IUPAC name is 4-amino-1-ethyl-N-(2-sulfamoylphenyl)pyrrole-2-carboxamide.

Molecular Properties

Compound Name4-amino-1-ethyl-N-(2-sulfamoylphenyl)pyrrole-2-carboxamide
PubChem CID61128385
Molecular FormulaC13H16N4O3S
Molecular Weight308.36 g/mol
Exact Mass308.09
IUPAC Name4-amino-1-ethyl-N-(2-sulfamoylphenyl)pyrrole-2-carboxamide
SMILESCCn1cc(N)cc1C(=O)Nc1ccccc1S(N)(=O)=O
InChIInChI=1S/C13H16N4O3S/c1-2-17-8-9(14)7-11(17)13(18)16-10-5-3-4-6-12(10)21(15,19)20/h3-8H,2,14H2,1H3,(H,16,18)(H2,15,19,20)
InChIKeyDBLGQWGIAQFASI-UHFFFAOYSA-N
XLogP0.99
TPSA120.21 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.36
LogP ≤ 50.99
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 4-amino-1-ethyl-N-(2-sulfamoylphenyl)pyrrole-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-amino-N-(2-methylsulfanylphenyl)-1-propylpyrrole-2-carboxamide
CID 61116942
4-amino-1-ethyl-N-(3-iodophenyl)pyrrole-2-carboxamide
CID 43643246
4-amino-N-(5-bromo-2-methylphenyl)-1-ethylpyrrole-2-carboxamide
CID 43805818
4-amino-1-ethyl-N-(4-methylphenyl)pyrrole-2-carboxamide
CID 43642219
methyl 3-[(4-amino-1-ethylpyrrole-2-carbonyl)amino]benzoate
CID 61112066
4-amino-N-(5-chloro-2-methoxyphenyl)-1-ethylpyrrole-2-carboxamide
CID 43642936
4-amino-N-[(2-bromophenyl)methyl]-1-ethylpyrrole-2-carboxamide
CID 61401810
4-amino-1-ethyl-N-[4-(trifluoromethyl)phenyl]pyrrole-2-carboxamide
CID 43642862
4-amino-1-ethyl-N-(3-methyl-2-pyridinyl)pyrrole-2-carboxamide
CID 43643038
4-amino-N-(1H-benzimidazol-2-yl)-1-ethylpyrrole-2-carboxamide
CID 63563293
4-amino-1-ethyl-N-(2-methylbutan-2-yl)pyrrole-2-carboxamide
CID 43641881
4-amino-N-(3-ethoxyphenyl)-1-ethylpyrrole-2-carboxamide
CID 61103176

Frequently Asked Questions

What is the IUPAC name of 4-amino-1-ethyl-N-(2-sulfamoylphenyl)pyrrole-2-carboxamide?
The IUPAC name of 4-amino-1-ethyl-N-(2-sulfamoylphenyl)pyrrole-2-carboxamide (CID 61128385) is 4-amino-1-ethyl-N-(2-sulfamoylphenyl)pyrrole-2-carboxamide.
What is the SMILES notation for 4-amino-1-ethyl-N-(2-sulfamoylphenyl)pyrrole-2-carboxamide?
The canonical SMILES for 4-amino-1-ethyl-N-(2-sulfamoylphenyl)pyrrole-2-carboxamide is CCn1cc(N)cc1C(=O)Nc1ccccc1S(N)(=O)=O.
What is the InChIKey of 4-amino-1-ethyl-N-(2-sulfamoylphenyl)pyrrole-2-carboxamide?
The InChIKey is DBLGQWGIAQFASI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4O3S/c1-2-17-8-9(14)7-11(17)13(18)16-10-5-3-4-6-12(10)21(15,19)20/h3-8H,2,14H2,1H3,(H,16,18)(H2,15,19,20).
What are the key properties of 4-amino-1-ethyl-N-(2-sulfamoylphenyl)pyrrole-2-carboxamide?
4-amino-1-ethyl-N-(2-sulfamoylphenyl)pyrrole-2-carboxamide has a molecular weight of 308.36 g/mol, XLogP of 0.99, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-1-ethyl-N-(2-sulfamoylphenyl)pyrrole-2-carboxamide is sourced from PubChem (CID 61128385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).