N-(2-bromo-4-sulfamoylphenyl)cyclopropanecarboxamide

C10H11BrN2O3S — CID 43134105

IUPACN-(2-bromo-4-sulfamoylphenyl)cyclopropanecarboxamide
SMILESNS(=O)(=O)c1ccc(NC(=O)C2CC2)c(Br)c1
InChIInChI=1S/C10H11BrN2O3S/c11-8-5-7(17(12,15)16)3-4-9(8)13-10(14)6-1-2-6/h3-6H,1-2H2,(H,13,14)(H2,12,15,16)
InChIKeyZGQAUDBAFWWDOU-UHFFFAOYSA-N
MW319.18 g/mol
LogP1.45
Rot. Bonds3

About N-(2-bromo-4-sulfamoylphenyl)cyclopropanecarboxamide

N-(2-bromo-4-sulfamoylphenyl)cyclopropanecarboxamide (PubChem CID 43134105) has the molecular formula C10H11BrN2O3S and a molecular weight of 319.18 g/mol. Its IUPAC name is N-(2-bromo-4-sulfamoylphenyl)cyclopropanecarboxamide.

Molecular Properties

Compound NameN-(2-bromo-4-sulfamoylphenyl)cyclopropanecarboxamide
PubChem CID43134105
Molecular FormulaC10H11BrN2O3S
Molecular Weight319.18 g/mol
Exact Mass317.97
IUPAC NameN-(2-bromo-4-sulfamoylphenyl)cyclopropanecarboxamide
SMILESNS(=O)(=O)c1ccc(NC(=O)C2CC2)c(Br)c1
InChIInChI=1S/C10H11BrN2O3S/c11-8-5-7(17(12,15)16)3-4-9(8)13-10(14)6-1-2-6/h3-6H,1-2H2,(H,13,14)(H2,12,15,16)
InChIKeyZGQAUDBAFWWDOU-UHFFFAOYSA-N
XLogP1.45
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.18
LogP ≤ 51.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(3R)-N-(2-bromo-4-sulfamoylphenyl)piperidine-3-carboxamide
CID 81125256
(3S)-N-(2-bromo-4-sulfamoylphenyl)piperidine-3-carboxamide
CID 81125110
N-(2-fluoro-5-sulfamoylphenyl)cyclopropanecarboxamide
CID 61130725
N-(2-bromo-4-sulfamoylphenyl)-1,3-thiazolidine-4-carboxamide
CID 43711294
N-(2-fluoro-5-sulfamoylphenyl)cyclopentanecarboxamide
CID 61129788
N-(2-chloro-5-sulfamoylphenyl)cyclobutanecarboxamide
CID 61131077
N-(2-bromo-4-sulfamoylphenyl)thiomorpholine-3-carboxamide
CID 82908517
N-(4-amino-2-bromophenyl)cyclohexanecarboxamide
CID 1133414
2-amino-N-(2-bromo-4-sulfamoylphenyl)-2-methylpropanamide
CID 61265216
4-bromo-N-(2-bromo-4-sulfamoylphenyl)benzamide
CID 43246759
4-amino-N-(2-bromo-4-sulfamoylphenyl)benzamide
CID 43711286
3-amino-N-(2-methyl-5-sulfamoylphenyl)cyclopentane-1-carboxamide
CID 66008738

Frequently Asked Questions

What is the IUPAC name of N-(2-bromo-4-sulfamoylphenyl)cyclopropanecarboxamide?
The IUPAC name of N-(2-bromo-4-sulfamoylphenyl)cyclopropanecarboxamide (CID 43134105) is N-(2-bromo-4-sulfamoylphenyl)cyclopropanecarboxamide.
What is the SMILES notation for N-(2-bromo-4-sulfamoylphenyl)cyclopropanecarboxamide?
The canonical SMILES for N-(2-bromo-4-sulfamoylphenyl)cyclopropanecarboxamide is NS(=O)(=O)c1ccc(NC(=O)C2CC2)c(Br)c1.
What is the InChIKey of N-(2-bromo-4-sulfamoylphenyl)cyclopropanecarboxamide?
The InChIKey is ZGQAUDBAFWWDOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11BrN2O3S/c11-8-5-7(17(12,15)16)3-4-9(8)13-10(14)6-1-2-6/h3-6H,1-2H2,(H,13,14)(H2,12,15,16).
What are the key properties of N-(2-bromo-4-sulfamoylphenyl)cyclopropanecarboxamide?
N-(2-bromo-4-sulfamoylphenyl)cyclopropanecarboxamide has a molecular weight of 319.18 g/mol, XLogP of 1.45, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromo-4-sulfamoylphenyl)cyclopropanecarboxamide is sourced from PubChem (CID 43134105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).