4-chloro-1-methyl-N-(2-sulfamoylethyl)pyrrole-2-carboxamide

C8H12ClN3O3S — CID 61066534

IUPAC4-chloro-1-methyl-N-(2-sulfamoylethyl)pyrrole-2-carboxamide
SMILESCn1cc(Cl)cc1C(=O)NCCS(N)(=O)=O
InChIInChI=1S/C8H12ClN3O3S/c1-12-5-6(9)4-7(12)8(13)11-2-3-16(10,14)15/h4-5H,2-3H2,1H3,(H,11,13)(H2,10,14,15)
InChIKeyFFODJWWNWDYFPW-UHFFFAOYSA-N
MW265.72 g/mol
LogP-0.30
Rot. Bonds4

About 4-chloro-1-methyl-N-(2-sulfamoylethyl)pyrrole-2-carboxamide

4-chloro-1-methyl-N-(2-sulfamoylethyl)pyrrole-2-carboxamide (PubChem CID 61066534) has the molecular formula C8H12ClN3O3S and a molecular weight of 265.72 g/mol. Its IUPAC name is 4-chloro-1-methyl-N-(2-sulfamoylethyl)pyrrole-2-carboxamide.

Molecular Properties

Compound Name4-chloro-1-methyl-N-(2-sulfamoylethyl)pyrrole-2-carboxamide
PubChem CID61066534
Molecular FormulaC8H12ClN3O3S
Molecular Weight265.72 g/mol
Exact Mass265.03
IUPAC Name4-chloro-1-methyl-N-(2-sulfamoylethyl)pyrrole-2-carboxamide
SMILESCn1cc(Cl)cc1C(=O)NCCS(N)(=O)=O
InChIInChI=1S/C8H12ClN3O3S/c1-12-5-6(9)4-7(12)8(13)11-2-3-16(10,14)15/h4-5H,2-3H2,1H3,(H,11,13)(H2,10,14,15)
InChIKeyFFODJWWNWDYFPW-UHFFFAOYSA-N
XLogP-0.30
TPSA94.19 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.72
LogP ≤ 5-0.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 4-chloro-1-methyl-N-(2-sulfamoylethyl)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-chloro-N-(4-hydroxybutyl)-1-methylpyrrole-2-carboxamide
CID 106843318
4-chloro-1-ethyl-N-(3-sulfamoylpropyl)pyrrole-2-carboxamide
CID 61132430
N-(2-amino-2-ethylbutyl)-4-chloro-1-methylpyrrole-2-carboxamide
CID 81484909
4-chloro-N-[2-(cyclopropylamino)ethyl]-1-methylpyrrole-2-carboxamide
CID 62665276
4-chloro-N-[2-(3-hydroxypropylsulfanyl)ethyl]-1-methylpyrrole-2-carboxamide
CID 113264624
2,4,6-trimethyl-N-(2-sulfamoylethyl)benzamide
CID 61128957
2-[[2-[(4-chloro-1-methylpyrrole-2-carbonyl)amino]acetyl]amino]acetic acid
CID 43465535
4-chloro-N-[(5-chlorothiophen-2-yl)methyl]-1-methylpyrrole-2-carboxamide
CID 32831369
4-chloro-1-methyl-N-[2-(1H-1,2,4-triazol-5-yl)ethyl]pyrrole-2-carboxamide
CID 64545994
4-chloro-1-methyl-N-[2-(1,2,3,6-tetrahydropyridin-4-yl)ethyl]pyrrole-2-carboxamide
CID 107487479
1-methyl-N-(3-methylsulfonylpropyl)-4-sulfamoylpyrrole-2-carboxamide
CID 61149529
N-(2-aminoethyl)-1,4-dimethylpyrrole-2-carboxamide
CID 140567735

Frequently Asked Questions

What is the IUPAC name of 4-chloro-1-methyl-N-(2-sulfamoylethyl)pyrrole-2-carboxamide?
The IUPAC name of 4-chloro-1-methyl-N-(2-sulfamoylethyl)pyrrole-2-carboxamide (CID 61066534) is 4-chloro-1-methyl-N-(2-sulfamoylethyl)pyrrole-2-carboxamide.
What is the SMILES notation for 4-chloro-1-methyl-N-(2-sulfamoylethyl)pyrrole-2-carboxamide?
The canonical SMILES for 4-chloro-1-methyl-N-(2-sulfamoylethyl)pyrrole-2-carboxamide is Cn1cc(Cl)cc1C(=O)NCCS(N)(=O)=O.
What is the InChIKey of 4-chloro-1-methyl-N-(2-sulfamoylethyl)pyrrole-2-carboxamide?
The InChIKey is FFODJWWNWDYFPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12ClN3O3S/c1-12-5-6(9)4-7(12)8(13)11-2-3-16(10,14)15/h4-5H,2-3H2,1H3,(H,11,13)(H2,10,14,15).
What are the key properties of 4-chloro-1-methyl-N-(2-sulfamoylethyl)pyrrole-2-carboxamide?
4-chloro-1-methyl-N-(2-sulfamoylethyl)pyrrole-2-carboxamide has a molecular weight of 265.72 g/mol, XLogP of -0.30, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-1-methyl-N-(2-sulfamoylethyl)pyrrole-2-carboxamide is sourced from PubChem (CID 61066534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).