3-amino-1-propyl-N-(1-pyridin-2-ylethyl)pyrazole-4-sulfonamide

C13H19N5O2S — CID 60808797

IUPAC3-amino-1-propyl-N-(1-pyridin-2-ylethyl)pyrazole-4-sulfonamide
SMILESCCCn1cc(S(=O)(=O)NC(C)c2ccccn2)c(N)n1
InChIInChI=1S/C13H19N5O2S/c1-3-8-18-9-12(13(14)16-18)21(19,20)17-10(2)11-6-4-5-7-15-11/h4-7,9-10,17H,3,8H2,1-2H3,(H2,14,16)
InChIKeyPWRHOMRYFAXPHM-UHFFFAOYSA-N
MW309.39 g/mol
LogP1.31
Rot. Bonds6

About 3-amino-1-propyl-N-(1-pyridin-2-ylethyl)pyrazole-4-sulfonamide

3-amino-1-propyl-N-(1-pyridin-2-ylethyl)pyrazole-4-sulfonamide (PubChem CID 60808797) has the molecular formula C13H19N5O2S and a molecular weight of 309.39 g/mol. Its IUPAC name is 3-amino-1-propyl-N-(1-pyridin-2-ylethyl)pyrazole-4-sulfonamide.

Molecular Properties

Compound Name3-amino-1-propyl-N-(1-pyridin-2-ylethyl)pyrazole-4-sulfonamide
PubChem CID60808797
Molecular FormulaC13H19N5O2S
Molecular Weight309.39 g/mol
Exact Mass309.13
IUPAC Name3-amino-1-propyl-N-(1-pyridin-2-ylethyl)pyrazole-4-sulfonamide
SMILESCCCn1cc(S(=O)(=O)NC(C)c2ccccn2)c(N)n1
InChIInChI=1S/C13H19N5O2S/c1-3-8-18-9-12(13(14)16-18)21(19,20)17-10(2)11-6-4-5-7-15-11/h4-7,9-10,17H,3,8H2,1-2H3,(H2,14,16)
InChIKeyPWRHOMRYFAXPHM-UHFFFAOYSA-N
XLogP1.31
TPSA102.90 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.39
LogP ≤ 51.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 3-amino-1-propyl-N-(1-pyridin-2-ylethyl)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

3-amino-N-(1-phenylethyl)-1-propylpyrazole-4-sulfonamide
CID 60814855
3-amino-N-but-3-en-2-yl-1-propylpyrazole-4-sulfonamide
CID 113480784
3-amino-N-(2-methylphenyl)-1-propylpyrazole-4-sulfonamide
CID 60808427
2-[(3-amino-1-propylpyrazol-4-yl)sulfonylamino]-N-ethylpropanamide
CID 60810102
3-amino-N-(2-methyl-4-pyridinyl)-1-propylpyrazole-4-sulfonamide
CID 79234839
3-amino-N-(2-methoxyphenyl)-1-propylpyrazole-4-sulfonamide
CID 60810232
3-amino-N-(2,3-dimethylbutyl)-1-propylpyrazole-4-sulfonamide
CID 64570397
2-(ethylamino)-N-(1-pyridin-2-ylethyl)pyridine-3-sulfonamide
CID 62145879
N-[(1S)-1-pyridin-2-ylethyl]propane-1-sulfonamide
CID 78980226
2-bromo-N-(1-pyridin-2-ylethyl)benzenesulfonamide
CID 46799998
N-(1-pyridin-2-ylethyl)methanesulfonamide
CID 60681407
3-amino-N-(4-methylpentyl)-1-propylpyrazole-4-sulfonamide
CID 61125115

Frequently Asked Questions

What is the IUPAC name of 3-amino-1-propyl-N-(1-pyridin-2-ylethyl)pyrazole-4-sulfonamide?
The IUPAC name of 3-amino-1-propyl-N-(1-pyridin-2-ylethyl)pyrazole-4-sulfonamide (CID 60808797) is 3-amino-1-propyl-N-(1-pyridin-2-ylethyl)pyrazole-4-sulfonamide.
What is the SMILES notation for 3-amino-1-propyl-N-(1-pyridin-2-ylethyl)pyrazole-4-sulfonamide?
The canonical SMILES for 3-amino-1-propyl-N-(1-pyridin-2-ylethyl)pyrazole-4-sulfonamide is CCCn1cc(S(=O)(=O)NC(C)c2ccccn2)c(N)n1.
What is the InChIKey of 3-amino-1-propyl-N-(1-pyridin-2-ylethyl)pyrazole-4-sulfonamide?
The InChIKey is PWRHOMRYFAXPHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N5O2S/c1-3-8-18-9-12(13(14)16-18)21(19,20)17-10(2)11-6-4-5-7-15-11/h4-7,9-10,17H,3,8H2,1-2H3,(H2,14,16).
What are the key properties of 3-amino-1-propyl-N-(1-pyridin-2-ylethyl)pyrazole-4-sulfonamide?
3-amino-1-propyl-N-(1-pyridin-2-ylethyl)pyrazole-4-sulfonamide has a molecular weight of 309.39 g/mol, XLogP of 1.31, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-1-propyl-N-(1-pyridin-2-ylethyl)pyrazole-4-sulfonamide is sourced from PubChem (CID 60808797), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).