N-[4-(4-fluoropyrazol-1-yl)-3-sulfamoylphenyl]acetamide

C11H11FN4O3S — CID 151538876

IUPACN-[4-(4-fluoropyrazol-1-yl)-3-sulfamoylphenyl]acetamide
SMILESCC(=O)Nc1ccc(-n2cc(F)cn2)c(S(N)(=O)=O)c1
InChIInChI=1S/C11H11FN4O3S/c1-7(17)15-9-2-3-10(11(4-9)20(13,18)19)16-6-8(12)5-14-16/h2-6H,1H3,(H,15,17)(H2,13,18,19)
InChIKeyPYAUWYZJPREEKC-UHFFFAOYSA-N
MW298.30 g/mol
LogP0.62
Rot. Bonds3

About N-[4-(4-fluoropyrazol-1-yl)-3-sulfamoylphenyl]acetamide

N-[4-(4-fluoropyrazol-1-yl)-3-sulfamoylphenyl]acetamide (PubChem CID 151538876) has the molecular formula C11H11FN4O3S and a molecular weight of 298.30 g/mol. Its IUPAC name is N-[4-(4-fluoropyrazol-1-yl)-3-sulfamoylphenyl]acetamide.

Molecular Properties

Compound NameN-[4-(4-fluoropyrazol-1-yl)-3-sulfamoylphenyl]acetamide
PubChem CID151538876
Molecular FormulaC11H11FN4O3S
Molecular Weight298.30 g/mol
Exact Mass298.05
IUPAC NameN-[4-(4-fluoropyrazol-1-yl)-3-sulfamoylphenyl]acetamide
SMILESCC(=O)Nc1ccc(-n2cc(F)cn2)c(S(N)(=O)=O)c1
InChIInChI=1S/C11H11FN4O3S/c1-7(17)15-9-2-3-10(11(4-9)20(13,18)19)16-6-8(12)5-14-16/h2-6H,1H3,(H,15,17)(H2,13,18,19)
InChIKeyPYAUWYZJPREEKC-UHFFFAOYSA-N
XLogP0.62
TPSA107.08 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.30
LogP ≤ 50.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[4-(4-fluoropyrazol-1-yl)-3-sulfamoylphenyl]acetamide?
The IUPAC name of N-[4-(4-fluoropyrazol-1-yl)-3-sulfamoylphenyl]acetamide (CID 151538876) is N-[4-(4-fluoropyrazol-1-yl)-3-sulfamoylphenyl]acetamide.
What is the SMILES notation for N-[4-(4-fluoropyrazol-1-yl)-3-sulfamoylphenyl]acetamide?
The canonical SMILES for N-[4-(4-fluoropyrazol-1-yl)-3-sulfamoylphenyl]acetamide is CC(=O)Nc1ccc(-n2cc(F)cn2)c(S(N)(=O)=O)c1.
What is the InChIKey of N-[4-(4-fluoropyrazol-1-yl)-3-sulfamoylphenyl]acetamide?
The InChIKey is PYAUWYZJPREEKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11FN4O3S/c1-7(17)15-9-2-3-10(11(4-9)20(13,18)19)16-6-8(12)5-14-16/h2-6H,1H3,(H,15,17)(H2,13,18,19).
What are the key properties of N-[4-(4-fluoropyrazol-1-yl)-3-sulfamoylphenyl]acetamide?
N-[4-(4-fluoropyrazol-1-yl)-3-sulfamoylphenyl]acetamide has a molecular weight of 298.30 g/mol, XLogP of 0.62, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(4-fluoropyrazol-1-yl)-3-sulfamoylphenyl]acetamide is sourced from PubChem (CID 151538876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).