N-[2-(1H-imidazol-5-yl)ethyl]-1H-pyrazole-4-sulfonamide

C8H11N5O2S — CID 65231374

IUPACN-[2-(1H-imidazol-5-yl)ethyl]-1H-pyrazole-4-sulfonamide
SMILESO=S(=O)(NCCc1cnc[nH]1)c1cn[nH]c1
InChIInChI=1S/C8H11N5O2S/c14-16(15,8-4-11-12-5-8)13-2-1-7-3-9-6-10-7/h3-6,13H,1-2H2,(H,9,10)(H,11,12)
InChIKeyJJASQGHBTYSDNB-UHFFFAOYSA-N
MW241.28 g/mol
LogP-0.35
Rot. Bonds5

About N-[2-(1H-imidazol-5-yl)ethyl]-1H-pyrazole-4-sulfonamide

N-[2-(1H-imidazol-5-yl)ethyl]-1H-pyrazole-4-sulfonamide (PubChem CID 65231374) has the molecular formula C8H11N5O2S and a molecular weight of 241.28 g/mol. Its IUPAC name is N-[2-(1H-imidazol-5-yl)ethyl]-1H-pyrazole-4-sulfonamide.

Molecular Properties

Compound NameN-[2-(1H-imidazol-5-yl)ethyl]-1H-pyrazole-4-sulfonamide
PubChem CID65231374
Molecular FormulaC8H11N5O2S
Molecular Weight241.28 g/mol
Exact Mass241.06
IUPAC NameN-[2-(1H-imidazol-5-yl)ethyl]-1H-pyrazole-4-sulfonamide
SMILESO=S(=O)(NCCc1cnc[nH]1)c1cn[nH]c1
InChIInChI=1S/C8H11N5O2S/c14-16(15,8-4-11-12-5-8)13-2-1-7-3-9-6-10-7/h3-6,13H,1-2H2,(H,9,10)(H,11,12)
InChIKeyJJASQGHBTYSDNB-UHFFFAOYSA-N
XLogP-0.35
TPSA103.53 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.28
LogP ≤ 5-0.35
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze N-[2-(1H-imidazol-5-yl)ethyl]-1H-pyrazole-4-sulfonamide 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-[2-(1H-imidazol-5-yl)ethylsulfamoyl]-1H-pyrrole-2-carboxylic acid
CID 65231835
4-(aminomethyl)-N-[2-(1H-imidazol-5-yl)ethyl]benzenesulfonamide
CID 65231853
3-N-[2-(1H-imidazol-5-yl)ethyl]benzene-1,3-disulfonamide
CID 65231464
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
4-[2-(1H-imidazol-5-yl)ethylsulfamoyl]benzamide
CID 65231463
N-(2-methylsulfanylethyl)-1H-pyrazole-4-sulfonamide
CID 60916750
3-amino-N-[2-(1H-imidazol-5-yl)ethyl]-5-methylbenzenesulfonamide
CID 65230879
N-[2-(4-hydroxyphenyl)ethyl]-1H-pyrazole-4-sulfonamide
CID 54903977
3-(1H-imidazol-5-yl)-2-(1H-pyrazol-4-ylsulfonylamino)propanoic acid
CID 54937478
N-[2-(1,3-thiazol-2-yl)ethyl]-1H-pyrazole-4-sulfonamide
CID 49460068
N-[2-(furan-2-yl)ethyl]-1H-pyrazole-4-sulfonamide
CID 61026875

Frequently Asked Questions

What is the IUPAC name of N-[2-(1H-imidazol-5-yl)ethyl]-1H-pyrazole-4-sulfonamide?
The IUPAC name of N-[2-(1H-imidazol-5-yl)ethyl]-1H-pyrazole-4-sulfonamide (CID 65231374) is N-[2-(1H-imidazol-5-yl)ethyl]-1H-pyrazole-4-sulfonamide.
What is the SMILES notation for N-[2-(1H-imidazol-5-yl)ethyl]-1H-pyrazole-4-sulfonamide?
The canonical SMILES for N-[2-(1H-imidazol-5-yl)ethyl]-1H-pyrazole-4-sulfonamide is O=S(=O)(NCCc1cnc[nH]1)c1cn[nH]c1.
What is the InChIKey of N-[2-(1H-imidazol-5-yl)ethyl]-1H-pyrazole-4-sulfonamide?
The InChIKey is JJASQGHBTYSDNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N5O2S/c14-16(15,8-4-11-12-5-8)13-2-1-7-3-9-6-10-7/h3-6,13H,1-2H2,(H,9,10)(H,11,12).
What are the key properties of N-[2-(1H-imidazol-5-yl)ethyl]-1H-pyrazole-4-sulfonamide?
N-[2-(1H-imidazol-5-yl)ethyl]-1H-pyrazole-4-sulfonamide has a molecular weight of 241.28 g/mol, XLogP of -0.35, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1H-imidazol-5-yl)ethyl]-1H-pyrazole-4-sulfonamide is sourced from PubChem (CID 65231374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).