1-(2,6-dichlorophenyl)-N-[2-(methylamino)ethyl]methanesulfonamide

C10H14Cl2N2O2S — CID 119973248

IUPAC1-(2,6-dichlorophenyl)-N-[2-(methylamino)ethyl]methanesulfonamide
SMILESCNCCNS(=O)(=O)Cc1c(Cl)cccc1Cl
InChIInChI=1S/C10H14Cl2N2O2S/c1-13-5-6-14-17(15,16)7-8-9(11)3-2-4-10(8)12/h2-4,13-14H,5-7H2,1H3
InChIKeyHHYRFTGOQXGYNX-UHFFFAOYSA-N
MW297.21 g/mol
LogP1.63
Rot. Bonds6

About 1-(2,6-dichlorophenyl)-N-[2-(methylamino)ethyl]methanesulfonamide

1-(2,6-dichlorophenyl)-N-[2-(methylamino)ethyl]methanesulfonamide (PubChem CID 119973248) has the molecular formula C10H14Cl2N2O2S and a molecular weight of 297.21 g/mol. Its IUPAC name is 1-(2,6-dichlorophenyl)-N-[2-(methylamino)ethyl]methanesulfonamide.

Molecular Properties

Compound Name1-(2,6-dichlorophenyl)-N-[2-(methylamino)ethyl]methanesulfonamide
PubChem CID119973248
Molecular FormulaC10H14Cl2N2O2S
Molecular Weight297.21 g/mol
Exact Mass296.02
IUPAC Name1-(2,6-dichlorophenyl)-N-[2-(methylamino)ethyl]methanesulfonamide
SMILESCNCCNS(=O)(=O)Cc1c(Cl)cccc1Cl
InChIInChI=1S/C10H14Cl2N2O2S/c1-13-5-6-14-17(15,16)7-8-9(11)3-2-4-10(8)12/h2-4,13-14H,5-7H2,1H3
InChIKeyHHYRFTGOQXGYNX-UHFFFAOYSA-N
XLogP1.63
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.21
LogP ≤ 51.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-[(2-Chlorophenyl)methylsulfonyl]-4-methylpiperazine
CID 2989467
N-{2-[(2,6-dichlorobenzyl)sulfanyl]ethyl}methanesulfonamide
CID 2177616
1-[(2-Chlorophenyl)methylsulfonyl]-4-ethylpiperazine
CID 2985596
1-(4-Chlorophenyl)-N-[2-(Diethylamino)ethyl]methanesulfonamide
CID 71677773
2-[(4-Chlorophenyl)methylsulfonylamino]ethyl-diethylazanium
CID 78225416
1-(2-chlorophenyl)-N-(prop-2-en-1-yl)methanesulfonamide
CID 580640
1-(2-chlorophenyl)-N-methylmethanesulfonamide
CID 2986489
N-{2-[(2,4-dichlorobenzyl)sulfanyl]ethyl}methanesulfonamide
CID 2288043
1-(2-chlorophenyl)-N,N-dipropylmethanesulfonamide
CID 2986414
1-(2-chlorophenyl)-N,N-dimethylmethanesulfonamide
CID 2989488
1-(2-chloro-6-fluorophenyl)-N-(prop-2-en-1-yl)methanesulfonamide
CID 17741387
1-(2-chloro-6-fluorophenyl)-N-propylmethanesulfonamide
CID 17741411

Frequently Asked Questions

What is the IUPAC name of 1-(2,6-dichlorophenyl)-N-[2-(methylamino)ethyl]methanesulfonamide?
The IUPAC name of 1-(2,6-dichlorophenyl)-N-[2-(methylamino)ethyl]methanesulfonamide (CID 119973248) is 1-(2,6-dichlorophenyl)-N-[2-(methylamino)ethyl]methanesulfonamide.
What is the SMILES notation for 1-(2,6-dichlorophenyl)-N-[2-(methylamino)ethyl]methanesulfonamide?
The canonical SMILES for 1-(2,6-dichlorophenyl)-N-[2-(methylamino)ethyl]methanesulfonamide is CNCCNS(=O)(=O)Cc1c(Cl)cccc1Cl.
What is the InChIKey of 1-(2,6-dichlorophenyl)-N-[2-(methylamino)ethyl]methanesulfonamide?
The InChIKey is HHYRFTGOQXGYNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14Cl2N2O2S/c1-13-5-6-14-17(15,16)7-8-9(11)3-2-4-10(8)12/h2-4,13-14H,5-7H2,1H3.
What are the key properties of 1-(2,6-dichlorophenyl)-N-[2-(methylamino)ethyl]methanesulfonamide?
1-(2,6-dichlorophenyl)-N-[2-(methylamino)ethyl]methanesulfonamide has a molecular weight of 297.21 g/mol, XLogP of 1.63, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,6-dichlorophenyl)-N-[2-(methylamino)ethyl]methanesulfonamide is sourced from PubChem (CID 119973248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).