N-[4-(1H-imidazol-2-yl)phenyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide

C14H15N5O2S — CID 110726587

IUPACN-[4-(1H-imidazol-2-yl)phenyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide
SMILESCc1n[nH]c(C)c1S(=O)(=O)Nc1ccc(-c2ncc[nH]2)cc1
InChIInChI=1S/C14H15N5O2S/c1-9-13(10(2)18-17-9)22(20,21)19-12-5-3-11(4-6-12)14-15-7-8-16-14/h3-8,19H,1-2H3,(H,15,16)(H,17,18)
InChIKeyGLLZFSFDSBENAK-UHFFFAOYSA-N
MW317.37 g/mol
LogP2.22
Rot. Bonds4

About N-[4-(1H-imidazol-2-yl)phenyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide

N-[4-(1H-imidazol-2-yl)phenyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide (PubChem CID 110726587) has the molecular formula C14H15N5O2S and a molecular weight of 317.37 g/mol. Its IUPAC name is N-[4-(1H-imidazol-2-yl)phenyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide.

Molecular Properties

Compound NameN-[4-(1H-imidazol-2-yl)phenyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide
PubChem CID110726587
Molecular FormulaC14H15N5O2S
Molecular Weight317.37 g/mol
Exact Mass317.09
IUPAC NameN-[4-(1H-imidazol-2-yl)phenyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide
SMILESCc1n[nH]c(C)c1S(=O)(=O)Nc1ccc(-c2ncc[nH]2)cc1
InChIInChI=1S/C14H15N5O2S/c1-9-13(10(2)18-17-9)22(20,21)19-12-5-3-11(4-6-12)14-15-7-8-16-14/h3-8,19H,1-2H3,(H,15,16)(H,17,18)
InChIKeyGLLZFSFDSBENAK-UHFFFAOYSA-N
XLogP2.22
TPSA103.53 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.37
LogP ≤ 52.22
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze N-[4-(1H-imidazol-2-yl)phenyl]-3,5-dimethyl-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

N-(4-hydroxyphenyl)-3,5-dimethyl-1H-pyrazole-4-sulfonamide
CID 28785562
N-[4-(1H-imidazol-2-yl)phenyl]-3,4-dimethylbenzenesulfonamide
CID 110726562
N-[4-(aminomethyl)phenyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide
CID 28754462
3,5-dimethyl-N-[4-[(4-methylphenyl)methylamino]phenyl]-1H-pyrazole-4-sulfonamide
CID 112982208
N-[4-(1-hydroxyethyl)phenyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide
CID 43417190
3,5-dimethyl-N-(4-pyrazol-1-ylphenyl)-1H-pyrazole-4-sulfonamide
CID 39837097
N-(3,4-dichlorophenyl)-3,5-dimethyl-1H-pyrazole-4-sulfonamide
CID 26952341
N-[4-(2-aminoethyl)phenyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide
CID 28754608
N-[4-(3,4-dimethylanilino)phenyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide
CID 112986378
N-[4-(3-aminoprop-1-ynyl)phenyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide
CID 60813276
N-(3,5-dimethylphenyl)-3,5-dimethyl-1H-pyrazole-4-sulfonamide
CID 866897
N-[4-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonylamino]phenyl]-2,2,2-trifluoroacetamide
CID 112505341

Frequently Asked Questions

What is the IUPAC name of N-[4-(1H-imidazol-2-yl)phenyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide?
The IUPAC name of N-[4-(1H-imidazol-2-yl)phenyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide (CID 110726587) is N-[4-(1H-imidazol-2-yl)phenyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide.
What is the SMILES notation for N-[4-(1H-imidazol-2-yl)phenyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide?
The canonical SMILES for N-[4-(1H-imidazol-2-yl)phenyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide is Cc1n[nH]c(C)c1S(=O)(=O)Nc1ccc(-c2ncc[nH]2)cc1.
What is the InChIKey of N-[4-(1H-imidazol-2-yl)phenyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide?
The InChIKey is GLLZFSFDSBENAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N5O2S/c1-9-13(10(2)18-17-9)22(20,21)19-12-5-3-11(4-6-12)14-15-7-8-16-14/h3-8,19H,1-2H3,(H,15,16)(H,17,18).
What are the key properties of N-[4-(1H-imidazol-2-yl)phenyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide?
N-[4-(1H-imidazol-2-yl)phenyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide has a molecular weight of 317.37 g/mol, XLogP of 2.22, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(1H-imidazol-2-yl)phenyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide is sourced from PubChem (CID 110726587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).