5-amino-N-(2,4-dichlorophenyl)-2-ethylbenzenesulfonamide

C14H14Cl2N2O2S — CID 43256364

IUPAC5-amino-N-(2,4-dichlorophenyl)-2-ethylbenzenesulfonamide
SMILESCCc1ccc(N)cc1S(=O)(=O)Nc1ccc(Cl)cc1Cl
InChIInChI=1S/C14H14Cl2N2O2S/c1-2-9-3-5-11(17)8-14(9)21(19,20)18-13-6-4-10(15)7-12(13)16/h3-8,18H,2,17H2,1H3
InChIKeyFJLYTHLOBSVXQY-UHFFFAOYSA-N
MW345.25 g/mol
LogP3.94
Rot. Bonds4

About 5-amino-N-(2,4-dichlorophenyl)-2-ethylbenzenesulfonamide

5-amino-N-(2,4-dichlorophenyl)-2-ethylbenzenesulfonamide (PubChem CID 43256364) has the molecular formula C14H14Cl2N2O2S and a molecular weight of 345.25 g/mol. Its IUPAC name is 5-amino-N-(2,4-dichlorophenyl)-2-ethylbenzenesulfonamide.

Molecular Properties

Compound Name5-amino-N-(2,4-dichlorophenyl)-2-ethylbenzenesulfonamide
PubChem CID43256364
Molecular FormulaC14H14Cl2N2O2S
Molecular Weight345.25 g/mol
Exact Mass344.02
IUPAC Name5-amino-N-(2,4-dichlorophenyl)-2-ethylbenzenesulfonamide
SMILESCCc1ccc(N)cc1S(=O)(=O)Nc1ccc(Cl)cc1Cl
InChIInChI=1S/C14H14Cl2N2O2S/c1-2-9-3-5-11(17)8-14(9)21(19,20)18-13-6-4-10(15)7-12(13)16/h3-8,18H,2,17H2,1H3
InChIKeyFJLYTHLOBSVXQY-UHFFFAOYSA-N
XLogP3.94
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.25
LogP ≤ 53.94
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

5-amino-2-ethyl-N-(2-fluoro-4-methylphenyl)benzenesulfonamide
CID 43256631
5-amino-N-(4-bromo-3-chlorophenyl)-2-ethylbenzenesulfonamide
CID 107618486
5-amino-N-(5-chloro-2-methylphenyl)-2-methylbenzenesulfonamide
CID 28537891
5-amino-N-(4,6-dimethylpyrimidin-2-yl)-2-ethylbenzenesulfonamide
CID 43256532
2-amino-4-chloro-N-(2-ethylphenyl)benzenesulfonamide
CID 28524364
5-amino-2-ethyl-N-(4-ethyl-1H-pyrazol-5-yl)benzenesulfonamide
CID 104617190
5-(aminomethyl)-N-(2,4-dichlorophenyl)-2-methylthiophene-3-sulfonamide
CID 106057468
5-amino-N-(2-chloro-4-cyanophenyl)-2-fluorobenzenesulfonamide
CID 107806943
5-amino-2-ethyl-N-pentan-3-ylbenzenesulfonamide
CID 43255687
2-amino-4,6-dichloro-N-(2,4-dichlorophenyl)benzenesulfonamide
CID 43256363
5-amino-N-(2-bromo-5-chlorophenyl)-2-fluorobenzenesulfonamide
CID 81262650
2,5-dichloro-N-(2,4-dichlorophenyl)thiophene-3-sulfonamide
CID 18282859

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-(2,4-dichlorophenyl)-2-ethylbenzenesulfonamide?
The IUPAC name of 5-amino-N-(2,4-dichlorophenyl)-2-ethylbenzenesulfonamide (CID 43256364) is 5-amino-N-(2,4-dichlorophenyl)-2-ethylbenzenesulfonamide.
What is the SMILES notation for 5-amino-N-(2,4-dichlorophenyl)-2-ethylbenzenesulfonamide?
The canonical SMILES for 5-amino-N-(2,4-dichlorophenyl)-2-ethylbenzenesulfonamide is CCc1ccc(N)cc1S(=O)(=O)Nc1ccc(Cl)cc1Cl.
What is the InChIKey of 5-amino-N-(2,4-dichlorophenyl)-2-ethylbenzenesulfonamide?
The InChIKey is FJLYTHLOBSVXQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14Cl2N2O2S/c1-2-9-3-5-11(17)8-14(9)21(19,20)18-13-6-4-10(15)7-12(13)16/h3-8,18H,2,17H2,1H3.
What are the key properties of 5-amino-N-(2,4-dichlorophenyl)-2-ethylbenzenesulfonamide?
5-amino-N-(2,4-dichlorophenyl)-2-ethylbenzenesulfonamide has a molecular weight of 345.25 g/mol, XLogP of 3.94, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-(2,4-dichlorophenyl)-2-ethylbenzenesulfonamide is sourced from PubChem (CID 43256364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).