N-(2-amino-5-chlorophenyl)ethanesulfonamide

C8H11ClN2O2S — CID 16775889

IUPACN-(2-amino-5-chlorophenyl)ethanesulfonamide
SMILESCCS(=O)(=O)Nc1cc(Cl)ccc1N
InChIInChI=1S/C8H11ClN2O2S/c1-2-14(12,13)11-8-5-6(9)3-4-7(8)10/h3-5,11H,2,10H2,1H3
InChIKeyQSYPBCDJNQNMKF-UHFFFAOYSA-N
MW234.71 g/mol
LogP1.68
Rot. Bonds3

About N-(2-amino-5-chlorophenyl)ethanesulfonamide

N-(2-amino-5-chlorophenyl)ethanesulfonamide (PubChem CID 16775889) has the molecular formula C8H11ClN2O2S and a molecular weight of 234.71 g/mol. Its IUPAC name is N-(2-amino-5-chlorophenyl)ethanesulfonamide.

Molecular Properties

Compound NameN-(2-amino-5-chlorophenyl)ethanesulfonamide
PubChem CID16775889
Molecular FormulaC8H11ClN2O2S
Molecular Weight234.71 g/mol
Exact Mass234.02
IUPAC NameN-(2-amino-5-chlorophenyl)ethanesulfonamide
SMILESCCS(=O)(=O)Nc1cc(Cl)ccc1N
InChIInChI=1S/C8H11ClN2O2S/c1-2-14(12,13)11-8-5-6(9)3-4-7(8)10/h3-5,11H,2,10H2,1H3
InChIKeyQSYPBCDJNQNMKF-UHFFFAOYSA-N
XLogP1.68
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.71
LogP ≤ 51.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

1-amino-4-chloro-2-(dimethylsulfamoylamino)benzene
CID 28787801
N-(4-amino-2,5-dichlorophenyl)ethanesulfonamide
CID 57028316
2-N-(tert-butylsulfamoyl)-4-chlorobenzene-1,2-diamine
CID 114804191
N-(2-amino-5-chlorophenyl)-2-ethylsulfonylacetamide
CID 43444676
methyl 4-chloro-2-(ethylsulfonylamino)benzoate
CID 18350465
N-(2-amino-5-chlorophenyl)-5-ethylthiophene-2-sulfonamide
CID 61454311
N-(4-chloro-2-nitrophenyl)ethanesulfonamide
CID 60642818
N-(5-chloro-2-hydroxyphenyl)propane-1-sulfonamide
CID 43114648
N-(2-amino-5-chlorophenyl)-3,4-difluorobenzenesulfonamide
CID 43343902
4-chloro-2-N-(2-ethylphenyl)benzene-1,2-diamine
CID 115468565
N-(5-chloro-2-methylphenyl)butane-1-sulfonamide
CID 6466028
N-(4-chloro-2-fluorophenyl)propane-1-sulfonamide
CID 60640735

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-5-chlorophenyl)ethanesulfonamide?
The IUPAC name of N-(2-amino-5-chlorophenyl)ethanesulfonamide (CID 16775889) is N-(2-amino-5-chlorophenyl)ethanesulfonamide.
What is the SMILES notation for N-(2-amino-5-chlorophenyl)ethanesulfonamide?
The canonical SMILES for N-(2-amino-5-chlorophenyl)ethanesulfonamide is CCS(=O)(=O)Nc1cc(Cl)ccc1N.
What is the InChIKey of N-(2-amino-5-chlorophenyl)ethanesulfonamide?
The InChIKey is QSYPBCDJNQNMKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11ClN2O2S/c1-2-14(12,13)11-8-5-6(9)3-4-7(8)10/h3-5,11H,2,10H2,1H3.
What are the key properties of N-(2-amino-5-chlorophenyl)ethanesulfonamide?
N-(2-amino-5-chlorophenyl)ethanesulfonamide has a molecular weight of 234.71 g/mol, XLogP of 1.68, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-5-chlorophenyl)ethanesulfonamide is sourced from PubChem (CID 16775889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).