N-(2-imidazol-1-ylethyl)-1H-pyrazole-4-sulfonamide

C8H11N5O2S — CID 47364355

IUPACN-(2-imidazol-1-ylethyl)-1H-pyrazole-4-sulfonamide
SMILESO=S(=O)(NCCn1ccnc1)c1cn[nH]c1
InChIInChI=1S/C8H11N5O2S/c14-16(15,8-5-10-11-6-8)12-2-4-13-3-1-9-7-13/h1,3,5-7,12H,2,4H2,(H,10,11)
InChIKeyANUSHLDDWYHBCC-UHFFFAOYSA-N
MW241.28 g/mol
LogP-0.42
Rot. Bonds5

About N-(2-imidazol-1-ylethyl)-1H-pyrazole-4-sulfonamide

N-(2-imidazol-1-ylethyl)-1H-pyrazole-4-sulfonamide (PubChem CID 47364355) has the molecular formula C8H11N5O2S and a molecular weight of 241.28 g/mol. Its IUPAC name is N-(2-imidazol-1-ylethyl)-1H-pyrazole-4-sulfonamide.

Molecular Properties

Compound NameN-(2-imidazol-1-ylethyl)-1H-pyrazole-4-sulfonamide
PubChem CID47364355
Molecular FormulaC8H11N5O2S
Molecular Weight241.28 g/mol
Exact Mass241.06
IUPAC NameN-(2-imidazol-1-ylethyl)-1H-pyrazole-4-sulfonamide
SMILESO=S(=O)(NCCn1ccnc1)c1cn[nH]c1
InChIInChI=1S/C8H11N5O2S/c14-16(15,8-5-10-11-6-8)12-2-4-13-3-1-9-7-13/h1,3,5-7,12H,2,4H2,(H,10,11)
InChIKeyANUSHLDDWYHBCC-UHFFFAOYSA-N
XLogP-0.42
TPSA92.67 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.28
LogP ≤ 5-0.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-(2-imidazol-1-ylethyl)-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

Frequently Asked Questions

What is the IUPAC name of N-(2-imidazol-1-ylethyl)-1H-pyrazole-4-sulfonamide?
The IUPAC name of N-(2-imidazol-1-ylethyl)-1H-pyrazole-4-sulfonamide (CID 47364355) is N-(2-imidazol-1-ylethyl)-1H-pyrazole-4-sulfonamide.
What is the SMILES notation for N-(2-imidazol-1-ylethyl)-1H-pyrazole-4-sulfonamide?
The canonical SMILES for N-(2-imidazol-1-ylethyl)-1H-pyrazole-4-sulfonamide is O=S(=O)(NCCn1ccnc1)c1cn[nH]c1.
What is the InChIKey of N-(2-imidazol-1-ylethyl)-1H-pyrazole-4-sulfonamide?
The InChIKey is ANUSHLDDWYHBCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N5O2S/c14-16(15,8-5-10-11-6-8)12-2-4-13-3-1-9-7-13/h1,3,5-7,12H,2,4H2,(H,10,11).
What are the key properties of N-(2-imidazol-1-ylethyl)-1H-pyrazole-4-sulfonamide?
N-(2-imidazol-1-ylethyl)-1H-pyrazole-4-sulfonamide has a molecular weight of 241.28 g/mol, XLogP of -0.42, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-imidazol-1-ylethyl)-1H-pyrazole-4-sulfonamide is sourced from PubChem (CID 47364355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).