N-(2-fluoro-5-sulfamoylphenyl)-2-methylcyclopentane-1-carboxamide

C13H17FN2O3S — CID 107182876

IUPACN-(2-fluoro-5-sulfamoylphenyl)-2-methylcyclopentane-1-carboxamide
SMILESCC1CCCC1C(=O)Nc1cc(S(N)(=O)=O)ccc1F
InChIInChI=1S/C13H17FN2O3S/c1-8-3-2-4-10(8)13(17)16-12-7-9(20(15,18)19)5-6-11(12)14/h5-8,10H,2-4H2,1H3,(H,16,17)(H2,15,18,19)
InChIKeyNTOFOTGRAFENRB-UHFFFAOYSA-N
MW300.35 g/mol
LogP1.85
Rot. Bonds3

About N-(2-fluoro-5-sulfamoylphenyl)-2-methylcyclopentane-1-carboxamide

N-(2-fluoro-5-sulfamoylphenyl)-2-methylcyclopentane-1-carboxamide (PubChem CID 107182876) has the molecular formula C13H17FN2O3S and a molecular weight of 300.35 g/mol. Its IUPAC name is N-(2-fluoro-5-sulfamoylphenyl)-2-methylcyclopentane-1-carboxamide.

Molecular Properties

Compound NameN-(2-fluoro-5-sulfamoylphenyl)-2-methylcyclopentane-1-carboxamide
PubChem CID107182876
Molecular FormulaC13H17FN2O3S
Molecular Weight300.35 g/mol
Exact Mass300.09
IUPAC NameN-(2-fluoro-5-sulfamoylphenyl)-2-methylcyclopentane-1-carboxamide
SMILESCC1CCCC1C(=O)Nc1cc(S(N)(=O)=O)ccc1F
InChIInChI=1S/C13H17FN2O3S/c1-8-3-2-4-10(8)13(17)16-12-7-9(20(15,18)19)5-6-11(12)14/h5-8,10H,2-4H2,1H3,(H,16,17)(H2,15,18,19)
InChIKeyNTOFOTGRAFENRB-UHFFFAOYSA-N
XLogP1.85
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.35
LogP ≤ 51.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-chloro-4-sulfamoylphenyl)-2-methylcyclopentane-1-carboxamide
CID 107180012
N-(2-fluoro-5-sulfamoylphenyl)-2-methyloxolane-3-carboxamide
CID 79762826
N-(2-fluoro-5-sulfamoylphenyl)cyclopentanecarboxamide
CID 61129788
N-(2-fluoro-5-sulfamoylphenyl)cyclopropanecarboxamide
CID 61130725
N-(2-fluoro-5-sulfamoylphenyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide
CID 66476009
1-cyclobutyl-3-(2-fluoro-5-sulfamoylphenyl)urea
CID 116658850
N-(2-fluoro-5-sulfamoylphenyl)-2,2-dimethylpropanamide
CID 61129967
2-amino-N-(2-methoxy-5-sulfamoylphenyl)cyclopentane-1-carboxamide
CID 64822574
N-(2-fluoro-5-sulfamoylphenyl)-1,4-dioxane-2-carboxamide
CID 62803145
N-(2-methoxy-5-sulfamoylphenyl)-2-methylcyclopropane-1-carboxamide
CID 47154229
N-(2-fluoro-5-sulfamoylphenyl)-1-methylcyclohexane-1-carboxamide
CID 106828727
N-(2-fluoro-4-sulfamoylphenyl)-3-methyloxolane-2-carboxamide
CID 81434051

Frequently Asked Questions

What is the IUPAC name of N-(2-fluoro-5-sulfamoylphenyl)-2-methylcyclopentane-1-carboxamide?
The IUPAC name of N-(2-fluoro-5-sulfamoylphenyl)-2-methylcyclopentane-1-carboxamide (CID 107182876) is N-(2-fluoro-5-sulfamoylphenyl)-2-methylcyclopentane-1-carboxamide.
What is the SMILES notation for N-(2-fluoro-5-sulfamoylphenyl)-2-methylcyclopentane-1-carboxamide?
The canonical SMILES for N-(2-fluoro-5-sulfamoylphenyl)-2-methylcyclopentane-1-carboxamide is CC1CCCC1C(=O)Nc1cc(S(N)(=O)=O)ccc1F.
What is the InChIKey of N-(2-fluoro-5-sulfamoylphenyl)-2-methylcyclopentane-1-carboxamide?
The InChIKey is NTOFOTGRAFENRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17FN2O3S/c1-8-3-2-4-10(8)13(17)16-12-7-9(20(15,18)19)5-6-11(12)14/h5-8,10H,2-4H2,1H3,(H,16,17)(H2,15,18,19).
What are the key properties of N-(2-fluoro-5-sulfamoylphenyl)-2-methylcyclopentane-1-carboxamide?
N-(2-fluoro-5-sulfamoylphenyl)-2-methylcyclopentane-1-carboxamide has a molecular weight of 300.35 g/mol, XLogP of 1.85, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluoro-5-sulfamoylphenyl)-2-methylcyclopentane-1-carboxamide is sourced from PubChem (CID 107182876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).