N-[(1,5-dimethylpyrazol-4-yl)methyl]-N,3-dimethyl-1-(2-methylpropyl)pyrazole-4-sulfonamide

C15H25N5O2S — CID 29089952

IUPACN-[(1,5-dimethylpyrazol-4-yl)methyl]-N,3-dimethyl-1-(2-methylpropyl)pyrazole-4-sulfonamide
SMILESCc1nn(CC(C)C)cc1S(=O)(=O)N(C)Cc1cnn(C)c1C
InChIInChI=1S/C15H25N5O2S/c1-11(2)8-20-10-15(12(3)17-20)23(21,22)18(5)9-14-7-16-19(6)13(14)4/h7,10-11H,8-9H2,1-6H3
InChIKeyJNSQCTBBUVVSLG-UHFFFAOYSA-N
MW339.47 g/mol
LogP1.71
Rot. Bonds6

About N-[(1,5-dimethylpyrazol-4-yl)methyl]-N,3-dimethyl-1-(2-methylpropyl)pyrazole-4-sulfonamide

N-[(1,5-dimethylpyrazol-4-yl)methyl]-N,3-dimethyl-1-(2-methylpropyl)pyrazole-4-sulfonamide (PubChem CID 29089952) has the molecular formula C15H25N5O2S and a molecular weight of 339.47 g/mol. Its IUPAC name is N-[(1,5-dimethylpyrazol-4-yl)methyl]-N,3-dimethyl-1-(2-methylpropyl)pyrazole-4-sulfonamide.

Molecular Properties

Compound NameN-[(1,5-dimethylpyrazol-4-yl)methyl]-N,3-dimethyl-1-(2-methylpropyl)pyrazole-4-sulfonamide
PubChem CID29089952
Molecular FormulaC15H25N5O2S
Molecular Weight339.47 g/mol
Exact Mass339.17
IUPAC NameN-[(1,5-dimethylpyrazol-4-yl)methyl]-N,3-dimethyl-1-(2-methylpropyl)pyrazole-4-sulfonamide
SMILESCc1nn(CC(C)C)cc1S(=O)(=O)N(C)Cc1cnn(C)c1C
InChIInChI=1S/C15H25N5O2S/c1-11(2)8-20-10-15(12(3)17-20)23(21,22)18(5)9-14-7-16-19(6)13(14)4/h7,10-11H,8-9H2,1-6H3
InChIKeyJNSQCTBBUVVSLG-UHFFFAOYSA-N
XLogP1.71
TPSA73.02 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.47
LogP ≤ 51.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze N-[(1,5-dimethylpyrazol-4-yl)methyl]-N,3-dimethyl-1-(2-methylpropyl)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-[(1,5-dimethylpyrazol-4-yl)methyl]-N,3-dimethyl-1-(2-methylpropyl)pyrazole-4-sulfonamide?
The IUPAC name of N-[(1,5-dimethylpyrazol-4-yl)methyl]-N,3-dimethyl-1-(2-methylpropyl)pyrazole-4-sulfonamide (CID 29089952) is N-[(1,5-dimethylpyrazol-4-yl)methyl]-N,3-dimethyl-1-(2-methylpropyl)pyrazole-4-sulfonamide.
What is the SMILES notation for N-[(1,5-dimethylpyrazol-4-yl)methyl]-N,3-dimethyl-1-(2-methylpropyl)pyrazole-4-sulfonamide?
The canonical SMILES for N-[(1,5-dimethylpyrazol-4-yl)methyl]-N,3-dimethyl-1-(2-methylpropyl)pyrazole-4-sulfonamide is Cc1nn(CC(C)C)cc1S(=O)(=O)N(C)Cc1cnn(C)c1C.
What is the InChIKey of N-[(1,5-dimethylpyrazol-4-yl)methyl]-N,3-dimethyl-1-(2-methylpropyl)pyrazole-4-sulfonamide?
The InChIKey is JNSQCTBBUVVSLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N5O2S/c1-11(2)8-20-10-15(12(3)17-20)23(21,22)18(5)9-14-7-16-19(6)13(14)4/h7,10-11H,8-9H2,1-6H3.
What are the key properties of N-[(1,5-dimethylpyrazol-4-yl)methyl]-N,3-dimethyl-1-(2-methylpropyl)pyrazole-4-sulfonamide?
N-[(1,5-dimethylpyrazol-4-yl)methyl]-N,3-dimethyl-1-(2-methylpropyl)pyrazole-4-sulfonamide has a molecular weight of 339.47 g/mol, XLogP of 1.71, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1,5-dimethylpyrazol-4-yl)methyl]-N,3-dimethyl-1-(2-methylpropyl)pyrazole-4-sulfonamide is sourced from PubChem (CID 29089952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).