N-(5-fluoro-2-sulfamoylphenyl)butanamide

C10H13FN2O3S — CID 61130555

IUPACN-(5-fluoro-2-sulfamoylphenyl)butanamide
SMILESCCCC(=O)Nc1cc(F)ccc1S(N)(=O)=O
InChIInChI=1S/C10H13FN2O3S/c1-2-3-10(14)13-8-6-7(11)4-5-9(8)17(12,15)16/h4-6H,2-3H2,1H3,(H,13,14)(H2,12,15,16)
InChIKeyPLWITDSYICFHSH-UHFFFAOYSA-N
MW260.29 g/mol
LogP1.21
Rot. Bonds4

About N-(5-fluoro-2-sulfamoylphenyl)butanamide

N-(5-fluoro-2-sulfamoylphenyl)butanamide (PubChem CID 61130555) has the molecular formula C10H13FN2O3S and a molecular weight of 260.29 g/mol. Its IUPAC name is N-(5-fluoro-2-sulfamoylphenyl)butanamide.

Molecular Properties

Compound NameN-(5-fluoro-2-sulfamoylphenyl)butanamide
PubChem CID61130555
Molecular FormulaC10H13FN2O3S
Molecular Weight260.29 g/mol
Exact Mass260.06
IUPAC NameN-(5-fluoro-2-sulfamoylphenyl)butanamide
SMILESCCCC(=O)Nc1cc(F)ccc1S(N)(=O)=O
InChIInChI=1S/C10H13FN2O3S/c1-2-3-10(14)13-8-6-7(11)4-5-9(8)17(12,15)16/h4-6H,2-3H2,1H3,(H,13,14)(H2,12,15,16)
InChIKeyPLWITDSYICFHSH-UHFFFAOYSA-N
XLogP1.21
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.29
LogP ≤ 51.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(5-fluoro-2-sulfamoylphenyl)butanamide?
The IUPAC name of N-(5-fluoro-2-sulfamoylphenyl)butanamide (CID 61130555) is N-(5-fluoro-2-sulfamoylphenyl)butanamide.
What is the SMILES notation for N-(5-fluoro-2-sulfamoylphenyl)butanamide?
The canonical SMILES for N-(5-fluoro-2-sulfamoylphenyl)butanamide is CCCC(=O)Nc1cc(F)ccc1S(N)(=O)=O.
What is the InChIKey of N-(5-fluoro-2-sulfamoylphenyl)butanamide?
The InChIKey is PLWITDSYICFHSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13FN2O3S/c1-2-3-10(14)13-8-6-7(11)4-5-9(8)17(12,15)16/h4-6H,2-3H2,1H3,(H,13,14)(H2,12,15,16).
What are the key properties of N-(5-fluoro-2-sulfamoylphenyl)butanamide?
N-(5-fluoro-2-sulfamoylphenyl)butanamide has a molecular weight of 260.29 g/mol, XLogP of 1.21, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-fluoro-2-sulfamoylphenyl)butanamide is sourced from PubChem (CID 61130555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).