N-(2-chloro-6-methylphenyl)-2-(methylamino)ethanesulfonamide

C10H15ClN2O2S — CID 66256869

IUPACN-(2-chloro-6-methylphenyl)-2-(methylamino)ethanesulfonamide
SMILESCNCCS(=O)(=O)Nc1c(C)cccc1Cl
InChIInChI=1S/C10H15ClN2O2S/c1-8-4-3-5-9(11)10(8)13-16(14,15)7-6-12-2/h3-5,12-13H,6-7H2,1-2H3
InChIKeyAWQPQHTXQVMUOV-UHFFFAOYSA-N
MW262.76 g/mol
LogP1.61
Rot. Bonds5

About N-(2-chloro-6-methylphenyl)-2-(methylamino)ethanesulfonamide

N-(2-chloro-6-methylphenyl)-2-(methylamino)ethanesulfonamide (PubChem CID 66256869) has the molecular formula C10H15ClN2O2S and a molecular weight of 262.76 g/mol. Its IUPAC name is N-(2-chloro-6-methylphenyl)-2-(methylamino)ethanesulfonamide.

Molecular Properties

Compound NameN-(2-chloro-6-methylphenyl)-2-(methylamino)ethanesulfonamide
PubChem CID66256869
Molecular FormulaC10H15ClN2O2S
Molecular Weight262.76 g/mol
Exact Mass262.05
IUPAC NameN-(2-chloro-6-methylphenyl)-2-(methylamino)ethanesulfonamide
SMILESCNCCS(=O)(=O)Nc1c(C)cccc1Cl
InChIInChI=1S/C10H15ClN2O2S/c1-8-4-3-5-9(11)10(8)13-16(14,15)7-6-12-2/h3-5,12-13H,6-7H2,1-2H3
InChIKeyAWQPQHTXQVMUOV-UHFFFAOYSA-N
XLogP1.61
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.76
LogP ≤ 51.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-chloro-6-fluorophenyl)-4-(methylamino)butane-1-sulfonamide
CID 114142281
1-[4-(aminomethyl)phenyl]-N-(2-chloro-6-methylphenyl)methanesulfonamide
CID 106070690
2-chloro-N-(ethylsulfonimidoyl)-6-methylaniline
CID 164644414
N-(2-fluoro-6-methylphenyl)-4-(methylamino)butane-1-sulfonamide
CID 106083706
N-(2-chloro-6-methylphenyl)-2-piperidin-2-ylethanesulfonamide
CID 66256676
N-(3-chloro-2-pyridinyl)-2-(methylamino)ethanesulfonamide
CID 103094659
N-(2-chloro-6-methylphenyl)-4-methylbenzenesulfonamide
CID 19256835
N,N'-bis(2-chloro-6-methylphenyl)methanediamine
CID 22450713
N-(2,6-dichloro-3-methylphenyl)-2-(ethylamino)ethanesulfonamide
CID 54973635
1-(2,6-dichlorophenyl)-N-[2-(methylamino)ethyl]methanesulfonamide
CID 119973248
N-(2,3-dichlorophenyl)-4-(methylamino)butane-1-sulfonamide
CID 106030648
1-(2-chlorophenyl)-N-(2-ethyl-6-methylphenyl)methanesulfonamide
CID 17257579

Frequently Asked Questions

What is the IUPAC name of N-(2-chloro-6-methylphenyl)-2-(methylamino)ethanesulfonamide?
The IUPAC name of N-(2-chloro-6-methylphenyl)-2-(methylamino)ethanesulfonamide (CID 66256869) is N-(2-chloro-6-methylphenyl)-2-(methylamino)ethanesulfonamide.
What is the SMILES notation for N-(2-chloro-6-methylphenyl)-2-(methylamino)ethanesulfonamide?
The canonical SMILES for N-(2-chloro-6-methylphenyl)-2-(methylamino)ethanesulfonamide is CNCCS(=O)(=O)Nc1c(C)cccc1Cl.
What is the InChIKey of N-(2-chloro-6-methylphenyl)-2-(methylamino)ethanesulfonamide?
The InChIKey is AWQPQHTXQVMUOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15ClN2O2S/c1-8-4-3-5-9(11)10(8)13-16(14,15)7-6-12-2/h3-5,12-13H,6-7H2,1-2H3.
What are the key properties of N-(2-chloro-6-methylphenyl)-2-(methylamino)ethanesulfonamide?
N-(2-chloro-6-methylphenyl)-2-(methylamino)ethanesulfonamide has a molecular weight of 262.76 g/mol, XLogP of 1.61, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chloro-6-methylphenyl)-2-(methylamino)ethanesulfonamide is sourced from PubChem (CID 66256869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).