5-amino-N-[3-(dimethylamino)propyl]-1-methylpyrazole-4-sulfonamide

C9H19N5O2S — CID 82459771

IUPAC5-amino-N-[3-(dimethylamino)propyl]-1-methylpyrazole-4-sulfonamide
SMILESCN(C)CCCNS(=O)(=O)c1cnn(C)c1N
InChIInChI=1S/C9H19N5O2S/c1-13(2)6-4-5-12-17(15,16)8-7-11-14(3)9(8)10/h7,12H,4-6,10H2,1-3H3
InChIKeyNSMFPTUKXAUTQD-UHFFFAOYSA-N
MW261.35 g/mol
LogP-0.77
Rot. Bonds6

About 5-amino-N-[3-(dimethylamino)propyl]-1-methylpyrazole-4-sulfonamide

5-amino-N-[3-(dimethylamino)propyl]-1-methylpyrazole-4-sulfonamide (PubChem CID 82459771) has the molecular formula C9H19N5O2S and a molecular weight of 261.35 g/mol. Its IUPAC name is 5-amino-N-[3-(dimethylamino)propyl]-1-methylpyrazole-4-sulfonamide.

Molecular Properties

Compound Name5-amino-N-[3-(dimethylamino)propyl]-1-methylpyrazole-4-sulfonamide
PubChem CID82459771
Molecular FormulaC9H19N5O2S
Molecular Weight261.35 g/mol
Exact Mass261.13
IUPAC Name5-amino-N-[3-(dimethylamino)propyl]-1-methylpyrazole-4-sulfonamide
SMILESCN(C)CCCNS(=O)(=O)c1cnn(C)c1N
InChIInChI=1S/C9H19N5O2S/c1-13(2)6-4-5-12-17(15,16)8-7-11-14(3)9(8)10/h7,12H,4-6,10H2,1-3H3
InChIKeyNSMFPTUKXAUTQD-UHFFFAOYSA-N
XLogP-0.77
TPSA93.25 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.35
LogP ≤ 5-0.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 5-amino-N-[3-(dimethylamino)propyl]-1-methylpyrazole-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

5-amino-N-(3-imidazol-1-ylpropyl)-1-methylpyrazole-4-sulfonamide
CID 82459797
N-[3-(dimethylamino)propyl]-1-ethyl-5-methylpyrazole-4-sulfonamide
CID 19681729
2-amino-N-[3-(dimethylamino)propyl]benzenesulfonamide
CID 16782691
5-amino-N-butyl-1-propylpyrazole-4-sulfonamide
CID 82459881
2-amino-N-[3-(dimethylamino)propyl]-5-methylsulfonylbenzenesulfonamide
CID 62145409
2-amino-5-bromo-N-[4-(dimethylamino)butyl]pyridine-3-sulfonamide
CID 62156630
2-amino-N-[3-(dimethylamino)propyl]-5-nitrobenzenesulfonamide
CID 23322298
2-amino-5-bromo-N-[3-(dimethylamino)propyl]benzenesulfonamide
CID 54888653
N-[3-(dimethylamino)propyl]-2-hydroxybenzenesulfonamide
CID 81242201
2-amino-N-[3-(dimethylamino)propyl]-5-nitrobenzenesulfonamide;hydrochloride
CID 23322297
5-amino-N-[3-(dimethylamino)propyl]-3-fluoro-2-methylbenzenesulfonamide
CID 79896277
2-amino-N-[3-(dimethylamino)propyl]pyridine-4-sulfonamide
CID 62145237

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-[3-(dimethylamino)propyl]-1-methylpyrazole-4-sulfonamide?
The IUPAC name of 5-amino-N-[3-(dimethylamino)propyl]-1-methylpyrazole-4-sulfonamide (CID 82459771) is 5-amino-N-[3-(dimethylamino)propyl]-1-methylpyrazole-4-sulfonamide.
What is the SMILES notation for 5-amino-N-[3-(dimethylamino)propyl]-1-methylpyrazole-4-sulfonamide?
The canonical SMILES for 5-amino-N-[3-(dimethylamino)propyl]-1-methylpyrazole-4-sulfonamide is CN(C)CCCNS(=O)(=O)c1cnn(C)c1N.
What is the InChIKey of 5-amino-N-[3-(dimethylamino)propyl]-1-methylpyrazole-4-sulfonamide?
The InChIKey is NSMFPTUKXAUTQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N5O2S/c1-13(2)6-4-5-12-17(15,16)8-7-11-14(3)9(8)10/h7,12H,4-6,10H2,1-3H3.
What are the key properties of 5-amino-N-[3-(dimethylamino)propyl]-1-methylpyrazole-4-sulfonamide?
5-amino-N-[3-(dimethylamino)propyl]-1-methylpyrazole-4-sulfonamide has a molecular weight of 261.35 g/mol, XLogP of -0.77, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-[3-(dimethylamino)propyl]-1-methylpyrazole-4-sulfonamide is sourced from PubChem (CID 82459771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).