N-[2-(methanesulfonamido)ethyl]-N-(2-methylphenyl)acetamide

C12H18N2O3S — CID 113057355

IUPACN-[2-(methanesulfonamido)ethyl]-N-(2-methylphenyl)acetamide
SMILESCC(=O)N(CCNS(C)(=O)=O)c1ccccc1C
InChIInChI=1S/C12H18N2O3S/c1-10-6-4-5-7-12(10)14(11(2)15)9-8-13-18(3,16)17/h4-7,13H,8-9H2,1-3H3
InChIKeyCJYMEVMSRLZGFO-UHFFFAOYSA-N
MW270.35 g/mol
LogP0.90
Rot. Bonds5

About N-[2-(methanesulfonamido)ethyl]-N-(2-methylphenyl)acetamide

N-[2-(methanesulfonamido)ethyl]-N-(2-methylphenyl)acetamide (PubChem CID 113057355) has the molecular formula C12H18N2O3S and a molecular weight of 270.35 g/mol. Its IUPAC name is N-[2-(methanesulfonamido)ethyl]-N-(2-methylphenyl)acetamide.

Molecular Properties

Compound NameN-[2-(methanesulfonamido)ethyl]-N-(2-methylphenyl)acetamide
PubChem CID113057355
Molecular FormulaC12H18N2O3S
Molecular Weight270.35 g/mol
Exact Mass270.10
IUPAC NameN-[2-(methanesulfonamido)ethyl]-N-(2-methylphenyl)acetamide
SMILESCC(=O)N(CCNS(C)(=O)=O)c1ccccc1C
InChIInChI=1S/C12H18N2O3S/c1-10-6-4-5-7-12(10)14(11(2)15)9-8-13-18(3,16)17/h4-7,13H,8-9H2,1-3H3
InChIKeyCJYMEVMSRLZGFO-UHFFFAOYSA-N
XLogP0.90
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.35
LogP ≤ 50.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-methylphenyl)-N-[2-[(4-propan-2-ylphenyl)sulfonylamino]ethyl]acetamide
CID 113057370
ethyl N-[2-(N-acetyl-2-methylanilino)ethyl]carbamate
CID 113057346
methyl 3-(N-acetyl-2-methylanilino)propanoate
CID 75507009
N-(4-chloro-3-oxobutyl)-N-(2-methylphenyl)acetamide
CID 104700970
N-(4-acetylphenyl)-N-[2-(methanesulfonamido)ethyl]acetamide
CID 113061694
N-[2-(N-acetyl-2-methylanilino)ethyl]-2-fluorobenzamide
CID 113057297
N-(4-fluorophenyl)-N-[2-(methanesulfonamido)ethyl]acetamide
CID 113059351
N-[2-(butylsulfonylamino)ethyl]-N-(2,3-dimethylphenyl)acetamide
CID 113058249
N-(3-chlorophenyl)-N-[2-(methanesulfonamido)ethyl]acetamide
CID 113059569
3-(N-acetyl-2-methylanilino)-N-[2-(dimethylamino)ethyl]propanamide
CID 113123546
3-(N-acetyl-2-methylanilino)-N-(2-methylphenyl)propanamide
CID 113123619
methyl 2-(N-acetyl-2-methylanilino)acetate
CID 20717630

Frequently Asked Questions

What is the IUPAC name of N-[2-(methanesulfonamido)ethyl]-N-(2-methylphenyl)acetamide?
The IUPAC name of N-[2-(methanesulfonamido)ethyl]-N-(2-methylphenyl)acetamide (CID 113057355) is N-[2-(methanesulfonamido)ethyl]-N-(2-methylphenyl)acetamide.
What is the SMILES notation for N-[2-(methanesulfonamido)ethyl]-N-(2-methylphenyl)acetamide?
The canonical SMILES for N-[2-(methanesulfonamido)ethyl]-N-(2-methylphenyl)acetamide is CC(=O)N(CCNS(C)(=O)=O)c1ccccc1C.
What is the InChIKey of N-[2-(methanesulfonamido)ethyl]-N-(2-methylphenyl)acetamide?
The InChIKey is CJYMEVMSRLZGFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O3S/c1-10-6-4-5-7-12(10)14(11(2)15)9-8-13-18(3,16)17/h4-7,13H,8-9H2,1-3H3.
What are the key properties of N-[2-(methanesulfonamido)ethyl]-N-(2-methylphenyl)acetamide?
N-[2-(methanesulfonamido)ethyl]-N-(2-methylphenyl)acetamide has a molecular weight of 270.35 g/mol, XLogP of 0.90, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(methanesulfonamido)ethyl]-N-(2-methylphenyl)acetamide is sourced from PubChem (CID 113057355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).