3-amino-N-(1-methylpyrrolidin-3-yl)-1-propylpyrazole-4-sulfonamide

C11H21N5O2S — CID 61462052

IUPAC3-amino-N-(1-methylpyrrolidin-3-yl)-1-propylpyrazole-4-sulfonamide
SMILESCCCn1cc(S(=O)(=O)NC2CCN(C)C2)c(N)n1
InChIInChI=1S/C11H21N5O2S/c1-3-5-16-8-10(11(12)13-16)19(17,18)14-9-4-6-15(2)7-9/h8-9,14H,3-7H2,1-2H3,(H2,12,13)
InChIKeyWPHMMHQXIBXBBL-UHFFFAOYSA-N
MW287.39 g/mol
LogP-0.14
Rot. Bonds5

About 3-amino-N-(1-methylpyrrolidin-3-yl)-1-propylpyrazole-4-sulfonamide

3-amino-N-(1-methylpyrrolidin-3-yl)-1-propylpyrazole-4-sulfonamide (PubChem CID 61462052) has the molecular formula C11H21N5O2S and a molecular weight of 287.39 g/mol. Its IUPAC name is 3-amino-N-(1-methylpyrrolidin-3-yl)-1-propylpyrazole-4-sulfonamide.

Molecular Properties

Compound Name3-amino-N-(1-methylpyrrolidin-3-yl)-1-propylpyrazole-4-sulfonamide
PubChem CID61462052
Molecular FormulaC11H21N5O2S
Molecular Weight287.39 g/mol
Exact Mass287.14
IUPAC Name3-amino-N-(1-methylpyrrolidin-3-yl)-1-propylpyrazole-4-sulfonamide
SMILESCCCn1cc(S(=O)(=O)NC2CCN(C)C2)c(N)n1
InChIInChI=1S/C11H21N5O2S/c1-3-5-16-8-10(11(12)13-16)19(17,18)14-9-4-6-15(2)7-9/h8-9,14H,3-7H2,1-2H3,(H2,12,13)
InChIKeyWPHMMHQXIBXBBL-UHFFFAOYSA-N
XLogP-0.14
TPSA93.25 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.39
LogP ≤ 5-0.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 3-amino-N-(1-methylpyrrolidin-3-yl)-1-propylpyrazole-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-cyclopentyl-1-propylpyrazole-4-sulfonamide
CID 54922795
3-amino-N-(1-ethylpiperidin-3-yl)-1-propylpyrazole-4-sulfonamide
CID 61170162
3-amino-N-(2-methyloxolan-3-yl)-1-propylpyrazole-4-sulfonamide
CID 82725524
3-amino-N-methyl-N-(1-methylpiperidin-4-yl)-1-propylpyrazole-4-sulfonamide
CID 60814704
3-amino-N-[(4-methylcyclohexyl)methyl]-1-propylpyrazole-4-sulfonamide
CID 63242905
3-amino-1-ethyl-N-(1-methyl-6-oxopiperidin-3-yl)pyrazole-4-sulfonamide
CID 64656103
3-amino-N-(2-cyclopentylethyl)-1-propylpyrazole-4-sulfonamide
CID 60919717
3-amino-N-cyclooctyl-1-ethylpyrazole-4-sulfonamide
CID 60808927
3-amino-N-[(1-methylpyrrolidin-2-yl)methyl]-1-propylpyrazole-4-sulfonamide
CID 106022301
3-amino-N-cyclopropyl-1-methylpyrazole-4-sulfonamide
CID 60814194
3-amino-N-(5-methylhexan-2-yl)-1-propylpyrazole-4-sulfonamide
CID 60808316
3-amino-N-but-2-ynyl-1-propylpyrazole-4-sulfonamide
CID 113464453

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(1-methylpyrrolidin-3-yl)-1-propylpyrazole-4-sulfonamide?
The IUPAC name of 3-amino-N-(1-methylpyrrolidin-3-yl)-1-propylpyrazole-4-sulfonamide (CID 61462052) is 3-amino-N-(1-methylpyrrolidin-3-yl)-1-propylpyrazole-4-sulfonamide.
What is the SMILES notation for 3-amino-N-(1-methylpyrrolidin-3-yl)-1-propylpyrazole-4-sulfonamide?
The canonical SMILES for 3-amino-N-(1-methylpyrrolidin-3-yl)-1-propylpyrazole-4-sulfonamide is CCCn1cc(S(=O)(=O)NC2CCN(C)C2)c(N)n1.
What is the InChIKey of 3-amino-N-(1-methylpyrrolidin-3-yl)-1-propylpyrazole-4-sulfonamide?
The InChIKey is WPHMMHQXIBXBBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N5O2S/c1-3-5-16-8-10(11(12)13-16)19(17,18)14-9-4-6-15(2)7-9/h8-9,14H,3-7H2,1-2H3,(H2,12,13).
What are the key properties of 3-amino-N-(1-methylpyrrolidin-3-yl)-1-propylpyrazole-4-sulfonamide?
3-amino-N-(1-methylpyrrolidin-3-yl)-1-propylpyrazole-4-sulfonamide has a molecular weight of 287.39 g/mol, XLogP of -0.14, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(1-methylpyrrolidin-3-yl)-1-propylpyrazole-4-sulfonamide is sourced from PubChem (CID 61462052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).