N-(2-amino-4,6-dichlorophenyl)methanesulfonamide

C7H8Cl2N2O2S — CID 16774025

IUPACN-(2-amino-4,6-dichlorophenyl)methanesulfonamide
SMILESCS(=O)(=O)Nc1c(N)cc(Cl)cc1Cl
InChIInChI=1S/C7H8Cl2N2O2S/c1-14(12,13)11-7-5(9)2-4(8)3-6(7)10/h2-3,11H,10H2,1H3
InChIKeyPLNQYAMKVLQBQX-UHFFFAOYSA-N
MW255.13 g/mol
LogP1.95
Rot. Bonds2

About N-(2-amino-4,6-dichlorophenyl)methanesulfonamide

N-(2-amino-4,6-dichlorophenyl)methanesulfonamide (PubChem CID 16774025) has the molecular formula C7H8Cl2N2O2S and a molecular weight of 255.13 g/mol. Its IUPAC name is N-(2-amino-4,6-dichlorophenyl)methanesulfonamide.

Molecular Properties

Compound NameN-(2-amino-4,6-dichlorophenyl)methanesulfonamide
PubChem CID16774025
Molecular FormulaC7H8Cl2N2O2S
Molecular Weight255.13 g/mol
Exact Mass253.97
IUPAC NameN-(2-amino-4,6-dichlorophenyl)methanesulfonamide
SMILESCS(=O)(=O)Nc1c(N)cc(Cl)cc1Cl
InChIInChI=1S/C7H8Cl2N2O2S/c1-14(12,13)11-7-5(9)2-4(8)3-6(7)10/h2-3,11H,10H2,1H3
InChIKeyPLNQYAMKVLQBQX-UHFFFAOYSA-N
XLogP1.95
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.13
LogP ≤ 51.95
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

3,5-dichloro-4-(methanesulfonamido)benzenesulfonamide
CID 43134231
3-amino-4-chloro-N-(2,4,6-trichlorophenyl)benzenesulfonamide
CID 28992287
N-(2-amino-4,6-dibromophenyl)methanesulfonamide
CID 43550705
2-amino-4-methyl-N-(2,4,6-trichlorophenyl)benzenesulfonamide
CID 43258819
N-(4-amino-5-chloro-2-hydroxyphenyl)methanesulfonamide
CID 22719137
2,4,6-trichloro-N-(3-methylsulfonylpropyl)aniline
CID 63190712
N-(2-amino-4,6-dichlorophenyl)-2-(dimethylamino)acetamide
CID 16789822
5-amino-N-(2,4,6-trichlorophenyl)-1H-pyrazole-4-sulfonamide
CID 54922613
2-amino-4,6-dichloro-N-(2,4-dichlorophenyl)benzenesulfonamide
CID 43256363
2-amino-4,6-dichloro-N-(5-chloro-2-methylphenyl)benzenesulfonamide
CID 43256501
2-amino-4,6-dichloro-N-(3,4-dimethylphenyl)benzenesulfonamide
CID 43255926
N-(3-amino-2,6-dimethylphenyl)methanesulfonamide
CID 24702132

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-4,6-dichlorophenyl)methanesulfonamide?
The IUPAC name of N-(2-amino-4,6-dichlorophenyl)methanesulfonamide (CID 16774025) is N-(2-amino-4,6-dichlorophenyl)methanesulfonamide.
What is the SMILES notation for N-(2-amino-4,6-dichlorophenyl)methanesulfonamide?
The canonical SMILES for N-(2-amino-4,6-dichlorophenyl)methanesulfonamide is CS(=O)(=O)Nc1c(N)cc(Cl)cc1Cl.
What is the InChIKey of N-(2-amino-4,6-dichlorophenyl)methanesulfonamide?
The InChIKey is PLNQYAMKVLQBQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8Cl2N2O2S/c1-14(12,13)11-7-5(9)2-4(8)3-6(7)10/h2-3,11H,10H2,1H3.
What are the key properties of N-(2-amino-4,6-dichlorophenyl)methanesulfonamide?
N-(2-amino-4,6-dichlorophenyl)methanesulfonamide has a molecular weight of 255.13 g/mol, XLogP of 1.95, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-4,6-dichlorophenyl)methanesulfonamide is sourced from PubChem (CID 16774025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).