5-amino-N-[2-(4-fluorophenyl)ethyl]-1H-pyrazole-4-sulfonamide

C11H13FN4O2S — CID 60808924

IUPAC5-amino-N-[2-(4-fluorophenyl)ethyl]-1H-pyrazole-4-sulfonamide
SMILESNc1[nH]ncc1S(=O)(=O)NCCc1ccc(F)cc1
InChIInChI=1S/C11H13FN4O2S/c12-9-3-1-8(2-4-9)5-6-15-19(17,18)10-7-14-16-11(10)13/h1-4,7,15H,5-6H2,(H3,13,14,16)
InChIKeyGEVBXLSRLZPVEO-UHFFFAOYSA-N
MW284.32 g/mol
LogP0.65
Rot. Bonds5

About 5-amino-N-[2-(4-fluorophenyl)ethyl]-1H-pyrazole-4-sulfonamide

5-amino-N-[2-(4-fluorophenyl)ethyl]-1H-pyrazole-4-sulfonamide (PubChem CID 60808924) has the molecular formula C11H13FN4O2S and a molecular weight of 284.32 g/mol. Its IUPAC name is 5-amino-N-[2-(4-fluorophenyl)ethyl]-1H-pyrazole-4-sulfonamide.

Molecular Properties

Compound Name5-amino-N-[2-(4-fluorophenyl)ethyl]-1H-pyrazole-4-sulfonamide
PubChem CID60808924
Molecular FormulaC11H13FN4O2S
Molecular Weight284.32 g/mol
Exact Mass284.07
IUPAC Name5-amino-N-[2-(4-fluorophenyl)ethyl]-1H-pyrazole-4-sulfonamide
SMILESNc1[nH]ncc1S(=O)(=O)NCCc1ccc(F)cc1
InChIInChI=1S/C11H13FN4O2S/c12-9-3-1-8(2-4-9)5-6-15-19(17,18)10-7-14-16-11(10)13/h1-4,7,15H,5-6H2,(H3,13,14,16)
InChIKeyGEVBXLSRLZPVEO-UHFFFAOYSA-N
XLogP0.65
TPSA100.87 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.32
LogP ≤ 50.65
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-N-[2-(4-fluorophenyl)ethyl]pyridine-3-sulfonamide
CID 62163350
5-amino-N-[2-(methylsulfamoyl)ethyl]-1H-pyrazole-4-sulfonamide
CID 114174781
3-amino-N-[2-(4-fluorophenyl)ethyl]-1-methylpyrazole-4-sulfonamide
CID 60808925
5-amino-N-[[4-(hydroxymethyl)phenyl]methyl]-1H-pyrazole-4-sulfonamide
CID 107229545
5-amino-2-bromo-N-[2-(4-fluorophenyl)ethyl]benzenesulfonamide
CID 65202093
N-[2-(4-hydroxyphenyl)ethyl]-5-methyl-1H-pyrazole-4-sulfonamide
CID 54903976
5-amino-N-[(3-chloro-4-fluorophenyl)methyl]-1H-pyrazole-4-sulfonamide
CID 62537243
3-amino-1-ethyl-N-[2-(4-fluorophenyl)ethyl]pyrazole-4-sulfonamide
CID 60809082
5-amino-N-(5-hydroxypentyl)-1H-pyrazole-4-sulfonamide
CID 107316396
N-[2-(4-fluorophenyl)ethyl]-2-methoxybenzenesulfonamide
CID 51170044
5-amino-N-[3-(1H-1,2,4-triazol-5-yl)propyl]-1H-pyrazole-4-sulfonamide
CID 64517232
6-amino-5-chloro-N-[2-(4-fluorophenyl)ethyl]pyridine-3-sulfonamide
CID 64606219

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-[2-(4-fluorophenyl)ethyl]-1H-pyrazole-4-sulfonamide?
The IUPAC name of 5-amino-N-[2-(4-fluorophenyl)ethyl]-1H-pyrazole-4-sulfonamide (CID 60808924) is 5-amino-N-[2-(4-fluorophenyl)ethyl]-1H-pyrazole-4-sulfonamide.
What is the SMILES notation for 5-amino-N-[2-(4-fluorophenyl)ethyl]-1H-pyrazole-4-sulfonamide?
The canonical SMILES for 5-amino-N-[2-(4-fluorophenyl)ethyl]-1H-pyrazole-4-sulfonamide is Nc1[nH]ncc1S(=O)(=O)NCCc1ccc(F)cc1.
What is the InChIKey of 5-amino-N-[2-(4-fluorophenyl)ethyl]-1H-pyrazole-4-sulfonamide?
The InChIKey is GEVBXLSRLZPVEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13FN4O2S/c12-9-3-1-8(2-4-9)5-6-15-19(17,18)10-7-14-16-11(10)13/h1-4,7,15H,5-6H2,(H3,13,14,16).
What are the key properties of 5-amino-N-[2-(4-fluorophenyl)ethyl]-1H-pyrazole-4-sulfonamide?
5-amino-N-[2-(4-fluorophenyl)ethyl]-1H-pyrazole-4-sulfonamide has a molecular weight of 284.32 g/mol, XLogP of 0.65, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-[2-(4-fluorophenyl)ethyl]-1H-pyrazole-4-sulfonamide is sourced from PubChem (CID 60808924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).