2-(2-aminoacetyl)-N,N-dimethylbenzenesulfonamide

C10H14N2O3S — CID 170861049

IUPAC2-(2-aminoacetyl)-N,N-dimethylbenzenesulfonamide
SMILESCN(C)S(=O)(=O)c1ccccc1C(=O)CN
InChIInChI=1S/C10H14N2O3S/c1-12(2)16(14,15)10-6-4-3-5-8(10)9(13)7-11/h3-6H,7,11H2,1-2H3
InChIKeyWNRAMLUHQMGXDV-UHFFFAOYSA-N
MW242.30 g/mol
LogP0.08
Rot. Bonds4

About 2-(2-aminoacetyl)-N,N-dimethylbenzenesulfonamide

2-(2-aminoacetyl)-N,N-dimethylbenzenesulfonamide (PubChem CID 170861049) has the molecular formula C10H14N2O3S and a molecular weight of 242.30 g/mol. Its IUPAC name is 2-(2-aminoacetyl)-N,N-dimethylbenzenesulfonamide.

Molecular Properties

Compound Name2-(2-aminoacetyl)-N,N-dimethylbenzenesulfonamide
PubChem CID170861049
Molecular FormulaC10H14N2O3S
Molecular Weight242.30 g/mol
Exact Mass242.07
IUPAC Name2-(2-aminoacetyl)-N,N-dimethylbenzenesulfonamide
SMILESCN(C)S(=O)(=O)c1ccccc1C(=O)CN
InChIInChI=1S/C10H14N2O3S/c1-12(2)16(14,15)10-6-4-3-5-8(10)9(13)7-11/h3-6H,7,11H2,1-2H3
InChIKeyWNRAMLUHQMGXDV-UHFFFAOYSA-N
XLogP0.08
TPSA80.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.30
LogP ≤ 50.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(1-hydroxyethyl)-N,N-dimethylbenzenesulfonamide
CID 14006033
2-[(2-amino-2-oxoethyl)-methylsulfamoyl]benzoic acid
CID 43374078
2-(3,3-dimethyl-2-oxobutyl)-N,N-dimethylbenzenesulfonamide
CID 63198745
2-[ethyl(methyl)sulfamoyl]benzoic acid
CID 43263319
2-[2-(dimethylsulfamoyl)-N-propan-2-ylanilino]acetic acid
CID 60829714
2-[2-(dimethylsulfamoyl)-N-methylanilino]acetic acid
CID 43454434
2-amino-1-[2-(diethylamino)phenyl]ethanone
CID 83820084
2-chloro-N-[[2-(dimethylsulfamoyl)phenyl]methyl]benzamide
CID 41266673
2-(dimethylsulfamoyl)-N-[1-(3-fluorophenyl)propan-2-yl]benzamide
CID 166235306
N-[[2-(dimethylsulfamoyl)phenyl]methyl]-2-propan-2-ylsulfanylbenzamide
CID 51319254
2-(3-aminobutylamino)-N,N-dimethylbenzenesulfonamide
CID 63251442
2-[(2-hydroxy-2-methylpropyl)-methylsulfamoyl]benzoic acid
CID 79390718

Frequently Asked Questions

What is the IUPAC name of 2-(2-aminoacetyl)-N,N-dimethylbenzenesulfonamide?
The IUPAC name of 2-(2-aminoacetyl)-N,N-dimethylbenzenesulfonamide (CID 170861049) is 2-(2-aminoacetyl)-N,N-dimethylbenzenesulfonamide.
What is the SMILES notation for 2-(2-aminoacetyl)-N,N-dimethylbenzenesulfonamide?
The canonical SMILES for 2-(2-aminoacetyl)-N,N-dimethylbenzenesulfonamide is CN(C)S(=O)(=O)c1ccccc1C(=O)CN.
What is the InChIKey of 2-(2-aminoacetyl)-N,N-dimethylbenzenesulfonamide?
The InChIKey is WNRAMLUHQMGXDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O3S/c1-12(2)16(14,15)10-6-4-3-5-8(10)9(13)7-11/h3-6H,7,11H2,1-2H3.
What are the key properties of 2-(2-aminoacetyl)-N,N-dimethylbenzenesulfonamide?
2-(2-aminoacetyl)-N,N-dimethylbenzenesulfonamide has a molecular weight of 242.30 g/mol, XLogP of 0.08, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-aminoacetyl)-N,N-dimethylbenzenesulfonamide is sourced from PubChem (CID 170861049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).