1-tert-butyl-N-(5-ethyl-1H-pyrazol-3-yl)-3,5-dimethylpyrazole-4-sulfonamide

C14H23N5O2S — CID 71850744

IUPAC1-tert-butyl-N-(5-ethyl-1H-pyrazol-3-yl)-3,5-dimethylpyrazole-4-sulfonamide
SMILESCCc1cc(NS(=O)(=O)c2c(C)nn(C(C)(C)C)c2C)n[nH]1
InChIInChI=1S/C14H23N5O2S/c1-7-11-8-12(16-15-11)18-22(20,21)13-9(2)17-19(10(13)3)14(4,5)6/h8H,7H2,1-6H3,(H2,15,16,18)
InChIKeyGLBWJBHNDKEYJS-UHFFFAOYSA-N
MW325.44 g/mol
LogP2.34
Rot. Bonds4

About 1-tert-butyl-N-(5-ethyl-1H-pyrazol-3-yl)-3,5-dimethylpyrazole-4-sulfonamide

1-tert-butyl-N-(5-ethyl-1H-pyrazol-3-yl)-3,5-dimethylpyrazole-4-sulfonamide (PubChem CID 71850744) has the molecular formula C14H23N5O2S and a molecular weight of 325.44 g/mol. Its IUPAC name is 1-tert-butyl-N-(5-ethyl-1H-pyrazol-3-yl)-3,5-dimethylpyrazole-4-sulfonamide.

Molecular Properties

Compound Name1-tert-butyl-N-(5-ethyl-1H-pyrazol-3-yl)-3,5-dimethylpyrazole-4-sulfonamide
PubChem CID71850744
Molecular FormulaC14H23N5O2S
Molecular Weight325.44 g/mol
Exact Mass325.16
IUPAC Name1-tert-butyl-N-(5-ethyl-1H-pyrazol-3-yl)-3,5-dimethylpyrazole-4-sulfonamide
SMILESCCc1cc(NS(=O)(=O)c2c(C)nn(C(C)(C)C)c2C)n[nH]1
InChIInChI=1S/C14H23N5O2S/c1-7-11-8-12(16-15-11)18-22(20,21)13-9(2)17-19(10(13)3)14(4,5)6/h8H,7H2,1-6H3,(H2,15,16,18)
InChIKeyGLBWJBHNDKEYJS-UHFFFAOYSA-N
XLogP2.34
TPSA92.67 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.44
LogP ≤ 52.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 1-tert-butyl-N-(5-ethyl-1H-pyrazol-3-yl)-3,5-dimethylpyrazole-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 1-tert-butyl-N-(5-ethyl-1H-pyrazol-3-yl)-3,5-dimethylpyrazole-4-sulfonamide?
The IUPAC name of 1-tert-butyl-N-(5-ethyl-1H-pyrazol-3-yl)-3,5-dimethylpyrazole-4-sulfonamide (CID 71850744) is 1-tert-butyl-N-(5-ethyl-1H-pyrazol-3-yl)-3,5-dimethylpyrazole-4-sulfonamide.
What is the SMILES notation for 1-tert-butyl-N-(5-ethyl-1H-pyrazol-3-yl)-3,5-dimethylpyrazole-4-sulfonamide?
The canonical SMILES for 1-tert-butyl-N-(5-ethyl-1H-pyrazol-3-yl)-3,5-dimethylpyrazole-4-sulfonamide is CCc1cc(NS(=O)(=O)c2c(C)nn(C(C)(C)C)c2C)n[nH]1.
What is the InChIKey of 1-tert-butyl-N-(5-ethyl-1H-pyrazol-3-yl)-3,5-dimethylpyrazole-4-sulfonamide?
The InChIKey is GLBWJBHNDKEYJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N5O2S/c1-7-11-8-12(16-15-11)18-22(20,21)13-9(2)17-19(10(13)3)14(4,5)6/h8H,7H2,1-6H3,(H2,15,16,18).
What are the key properties of 1-tert-butyl-N-(5-ethyl-1H-pyrazol-3-yl)-3,5-dimethylpyrazole-4-sulfonamide?
1-tert-butyl-N-(5-ethyl-1H-pyrazol-3-yl)-3,5-dimethylpyrazole-4-sulfonamide has a molecular weight of 325.44 g/mol, XLogP of 2.34, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-tert-butyl-N-(5-ethyl-1H-pyrazol-3-yl)-3,5-dimethylpyrazole-4-sulfonamide is sourced from PubChem (CID 71850744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).