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

C11H13FN2O3S — CID 61130728

IUPACN-(5-fluoro-2-sulfamoylphenyl)-2-methylcyclopropane-1-carboxamide
SMILESCC1CC1C(=O)Nc1cc(F)ccc1S(N)(=O)=O
InChIInChI=1S/C11H13FN2O3S/c1-6-4-8(6)11(15)14-9-5-7(12)2-3-10(9)18(13,16)17/h2-3,5-6,8H,4H2,1H3,(H,14,15)(H2,13,16,17)
InChIKeyIYMVLKJMOCJGOK-UHFFFAOYSA-N
MW272.30 g/mol
LogP1.07
Rot. Bonds3

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

N-(5-fluoro-2-sulfamoylphenyl)-2-methylcyclopropane-1-carboxamide (PubChem CID 61130728) has the molecular formula C11H13FN2O3S and a molecular weight of 272.30 g/mol. Its IUPAC name is N-(5-fluoro-2-sulfamoylphenyl)-2-methylcyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-(5-fluoro-2-sulfamoylphenyl)-2-methylcyclopropane-1-carboxamide
PubChem CID61130728
Molecular FormulaC11H13FN2O3S
Molecular Weight272.30 g/mol
Exact Mass272.06
IUPAC NameN-(5-fluoro-2-sulfamoylphenyl)-2-methylcyclopropane-1-carboxamide
SMILESCC1CC1C(=O)Nc1cc(F)ccc1S(N)(=O)=O
InChIInChI=1S/C11H13FN2O3S/c1-6-4-8(6)11(15)14-9-5-7(12)2-3-10(9)18(13,16)17/h2-3,5-6,8H,4H2,1H3,(H,14,15)(H2,13,16,17)
InChIKeyIYMVLKJMOCJGOK-UHFFFAOYSA-N
XLogP1.07
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.30
LogP ≤ 51.07
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)-2-methylcyclopropane-1-carboxamide?
The IUPAC name of N-(5-fluoro-2-sulfamoylphenyl)-2-methylcyclopropane-1-carboxamide (CID 61130728) is N-(5-fluoro-2-sulfamoylphenyl)-2-methylcyclopropane-1-carboxamide.
What is the SMILES notation for N-(5-fluoro-2-sulfamoylphenyl)-2-methylcyclopropane-1-carboxamide?
The canonical SMILES for N-(5-fluoro-2-sulfamoylphenyl)-2-methylcyclopropane-1-carboxamide is CC1CC1C(=O)Nc1cc(F)ccc1S(N)(=O)=O.
What is the InChIKey of N-(5-fluoro-2-sulfamoylphenyl)-2-methylcyclopropane-1-carboxamide?
The InChIKey is IYMVLKJMOCJGOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13FN2O3S/c1-6-4-8(6)11(15)14-9-5-7(12)2-3-10(9)18(13,16)17/h2-3,5-6,8H,4H2,1H3,(H,14,15)(H2,13,16,17).
What are the key properties of N-(5-fluoro-2-sulfamoylphenyl)-2-methylcyclopropane-1-carboxamide?
N-(5-fluoro-2-sulfamoylphenyl)-2-methylcyclopropane-1-carboxamide has a molecular weight of 272.30 g/mol, XLogP of 1.07, 3 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)-2-methylcyclopropane-1-carboxamide is sourced from PubChem (CID 61130728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).