2-[(2,6-dichlorophenyl)sulfonylamino]ethyl-dimethylazanium

C10H15Cl2N2O2S+ — CID 2128469

IUPAC2-[(2,6-dichlorophenyl)sulfonylamino]ethyl-dimethylazanium
SMILESC[NH+](C)CCNS(=O)(=O)c1c(Cl)cccc1Cl
InChIInChI=1S/C10H14Cl2N2O2S/c1-14(2)7-6-13-17(15,16)10-8(11)4-3-5-9(10)12/h3-5,13H,6-7H2,1-2H3/p+1
InChIKeyVSPDKZBBSJQNTB-UHFFFAOYSA-O
MW298.22 g/mol
LogP0.42
Rot. Bonds5

About 2-[(2,6-dichlorophenyl)sulfonylamino]ethyl-dimethylazanium

2-[(2,6-dichlorophenyl)sulfonylamino]ethyl-dimethylazanium (PubChem CID 2128469) has the molecular formula C10H15Cl2N2O2S+ and a molecular weight of 298.22 g/mol. Its IUPAC name is 2-[(2,6-dichlorophenyl)sulfonylamino]ethyl-dimethylazanium.

Molecular Properties

Compound Name2-[(2,6-dichlorophenyl)sulfonylamino]ethyl-dimethylazanium
PubChem CID2128469
Molecular FormulaC10H15Cl2N2O2S+
Molecular Weight298.22 g/mol
Exact Mass297.02
IUPAC Name2-[(2,6-dichlorophenyl)sulfonylamino]ethyl-dimethylazanium
SMILESC[NH+](C)CCNS(=O)(=O)c1c(Cl)cccc1Cl
InChIInChI=1S/C10H14Cl2N2O2S/c1-14(2)7-6-13-17(15,16)10-8(11)4-3-5-9(10)12/h3-5,13H,6-7H2,1-2H3/p+1
InChIKeyVSPDKZBBSJQNTB-UHFFFAOYSA-O
XLogP0.42
TPSA50.61 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.22
LogP ≤ 50.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(2,6-difluorophenyl)sulfonylamino]ethyl-dimethylazanium
CID 8716783
2,6-dichloro-N-[3-(methylamino)propyl]benzenesulfonamide
CID 43606022
2-[(4-chlorophenyl)sulfonylamino]ethyl-dimethylazanium
CID 4122196
3-[(2,6-dichlorophenyl)sulfonylamino]propanoic acid
CID 697936
N-(4-aminobutyl)-2,6-dichlorobenzenesulfonamide;hydrochloride
CID 120583800
2-amino-6-chloro-N-[3-(methanesulfonamido)propyl]benzenesulfonamide
CID 106333183
4-[(2,6-dichlorophenyl)sulfonylamino]-2-methylbutanoic acid
CID 80540414
2,6-dichloro-N-(2-hydroxy-2-methylpropyl)benzenesulfonamide
CID 65113165
2-amino-6-chloro-N-octylbenzenesulfonamide
CID 115565998
N-[2-(4-aminophenyl)ethyl]-2,6-dichlorobenzenesulfonamide
CID 63237501
2-chloro-N-[2-(2-chlorophenyl)ethyl]-6-methylbenzenesulfonamide
CID 146256445
2-bromo-6-chloro-N-prop-2-ynylbenzenesulfonamide
CID 130506038

Frequently Asked Questions

What is the IUPAC name of 2-[(2,6-dichlorophenyl)sulfonylamino]ethyl-dimethylazanium?
The IUPAC name of 2-[(2,6-dichlorophenyl)sulfonylamino]ethyl-dimethylazanium (CID 2128469) is 2-[(2,6-dichlorophenyl)sulfonylamino]ethyl-dimethylazanium.
What is the SMILES notation for 2-[(2,6-dichlorophenyl)sulfonylamino]ethyl-dimethylazanium?
The canonical SMILES for 2-[(2,6-dichlorophenyl)sulfonylamino]ethyl-dimethylazanium is C[NH+](C)CCNS(=O)(=O)c1c(Cl)cccc1Cl.
What is the InChIKey of 2-[(2,6-dichlorophenyl)sulfonylamino]ethyl-dimethylazanium?
The InChIKey is VSPDKZBBSJQNTB-UHFFFAOYSA-O. The full InChI is InChI=1S/C10H14Cl2N2O2S/c1-14(2)7-6-13-17(15,16)10-8(11)4-3-5-9(10)12/h3-5,13H,6-7H2,1-2H3/p+1.
What are the key properties of 2-[(2,6-dichlorophenyl)sulfonylamino]ethyl-dimethylazanium?
2-[(2,6-dichlorophenyl)sulfonylamino]ethyl-dimethylazanium has a molecular weight of 298.22 g/mol, XLogP of 0.42, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2,6-dichlorophenyl)sulfonylamino]ethyl-dimethylazanium is sourced from PubChem (CID 2128469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).