4-[2-(1H-imidazol-5-yl)ethylsulfamoyl]benzamide

C12H14N4O3S — CID 65231463

IUPAC4-[2-(1H-imidazol-5-yl)ethylsulfamoyl]benzamide
SMILESNC(=O)c1ccc(S(=O)(=O)NCCc2cnc[nH]2)cc1
InChIInChI=1S/C12H14N4O3S/c13-12(17)9-1-3-11(4-2-9)20(18,19)16-6-5-10-7-14-8-15-10/h1-4,7-8,16H,5-6H2,(H2,13,17)(H,14,15)
InChIKeyMYMPVKONUCZDGM-UHFFFAOYSA-N
MW294.34 g/mol
LogP0.03
Rot. Bonds6

About 4-[2-(1H-imidazol-5-yl)ethylsulfamoyl]benzamide

4-[2-(1H-imidazol-5-yl)ethylsulfamoyl]benzamide (PubChem CID 65231463) has the molecular formula C12H14N4O3S and a molecular weight of 294.34 g/mol. Its IUPAC name is 4-[2-(1H-imidazol-5-yl)ethylsulfamoyl]benzamide.

Molecular Properties

Compound Name4-[2-(1H-imidazol-5-yl)ethylsulfamoyl]benzamide
PubChem CID65231463
Molecular FormulaC12H14N4O3S
Molecular Weight294.34 g/mol
Exact Mass294.08
IUPAC Name4-[2-(1H-imidazol-5-yl)ethylsulfamoyl]benzamide
SMILESNC(=O)c1ccc(S(=O)(=O)NCCc2cnc[nH]2)cc1
InChIInChI=1S/C12H14N4O3S/c13-12(17)9-1-3-11(4-2-9)20(18,19)16-6-5-10-7-14-8-15-10/h1-4,7-8,16H,5-6H2,(H2,13,17)(H,14,15)
InChIKeyMYMPVKONUCZDGM-UHFFFAOYSA-N
XLogP0.03
TPSA117.94 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.34
LogP ≤ 50.03
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 4-[2-(1H-imidazol-5-yl)ethylsulfamoyl]benzamide 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-(aminomethyl)-N-[2-(1H-imidazol-5-yl)ethyl]benzenesulfonamide
CID 65231853
5-[2-(1H-imidazol-5-yl)ethylsulfamoyl]-2-methoxybenzamide
CID 146024582
3-N-[2-(1H-imidazol-5-yl)ethyl]benzene-1,3-disulfonamide
CID 65231464
N-[2-(1H-imidazol-5-yl)ethyl]-4-sulfamoylbenzamide
CID 10851318
4-[2-(1H-imidazol-5-yl)ethylsulfamoyl]-1H-pyrrole-2-carboxylic acid
CID 65231835
N-[2-(1H-imidazol-5-yl)ethyl]-1H-pyrazole-4-sulfonamide
CID 65231374
2-(1H-imidazol-5-yl)ethylurea
CID 10582986
N-[2-(1H-imidazol-5-yl)ethyl]-1-methylpyrrole-3-sulfonamide
CID 65231514
3-fluoro-N-[2-(1H-imidazol-5-yl)ethyl]benzenesulfonamide
CID 65231599
3-amino-N-[2-(1H-imidazol-5-yl)ethyl]-5-methylbenzenesulfonamide
CID 65230879
2-[2-(1H-imidazol-5-yl)ethylsulfamoyl]acetic acid
CID 65231882
4-chloro-N-[2-(1H-imidazol-5-yl)ethyl]-3-nitrobenzenesulfonamide
CID 40559388

Frequently Asked Questions

What is the IUPAC name of 4-[2-(1H-imidazol-5-yl)ethylsulfamoyl]benzamide?
The IUPAC name of 4-[2-(1H-imidazol-5-yl)ethylsulfamoyl]benzamide (CID 65231463) is 4-[2-(1H-imidazol-5-yl)ethylsulfamoyl]benzamide.
What is the SMILES notation for 4-[2-(1H-imidazol-5-yl)ethylsulfamoyl]benzamide?
The canonical SMILES for 4-[2-(1H-imidazol-5-yl)ethylsulfamoyl]benzamide is NC(=O)c1ccc(S(=O)(=O)NCCc2cnc[nH]2)cc1.
What is the InChIKey of 4-[2-(1H-imidazol-5-yl)ethylsulfamoyl]benzamide?
The InChIKey is MYMPVKONUCZDGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4O3S/c13-12(17)9-1-3-11(4-2-9)20(18,19)16-6-5-10-7-14-8-15-10/h1-4,7-8,16H,5-6H2,(H2,13,17)(H,14,15).
What are the key properties of 4-[2-(1H-imidazol-5-yl)ethylsulfamoyl]benzamide?
4-[2-(1H-imidazol-5-yl)ethylsulfamoyl]benzamide has a molecular weight of 294.34 g/mol, XLogP of 0.03, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(1H-imidazol-5-yl)ethylsulfamoyl]benzamide is sourced from PubChem (CID 65231463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).