2-[2-(methanesulfonamido)phenyl]-N-methylacetamide

C10H14N2O3S — CID 61061403

IUPAC2-[2-(methanesulfonamido)phenyl]-N-methylacetamide
SMILESCNC(=O)Cc1ccccc1NS(C)(=O)=O
InChIInChI=1S/C10H14N2O3S/c1-11-10(13)7-8-5-3-4-6-9(8)12-16(2,14)15/h3-6,12H,7H2,1-2H3,(H,11,13)
InChIKeyQPJRTLATUPIFHA-UHFFFAOYSA-N
MW242.30 g/mol
LogP0.35
Rot. Bonds4

About 2-[2-(methanesulfonamido)phenyl]-N-methylacetamide

2-[2-(methanesulfonamido)phenyl]-N-methylacetamide (PubChem CID 61061403) has the molecular formula C10H14N2O3S and a molecular weight of 242.30 g/mol. Its IUPAC name is 2-[2-(methanesulfonamido)phenyl]-N-methylacetamide.

Molecular Properties

Compound Name2-[2-(methanesulfonamido)phenyl]-N-methylacetamide
PubChem CID61061403
Molecular FormulaC10H14N2O3S
Molecular Weight242.30 g/mol
Exact Mass242.07
IUPAC Name2-[2-(methanesulfonamido)phenyl]-N-methylacetamide
SMILESCNC(=O)Cc1ccccc1NS(C)(=O)=O
InChIInChI=1S/C10H14N2O3S/c1-11-10(13)7-8-5-3-4-6-9(8)12-16(2,14)15/h3-6,12H,7H2,1-2H3,(H,11,13)
InChIKeyQPJRTLATUPIFHA-UHFFFAOYSA-N
XLogP0.35
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.30
LogP ≤ 50.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-2-[2-(sulfamoylamino)phenyl]acetamide
CID 112573434
N-methyl-2-(2-methylsulfonylphenyl)acetamide
CID 110487093
2-[2-[(3-chloro-2-methylpropyl)sulfonylamino]phenyl]-N-methylacetamide
CID 79585399
N-[2-(2-hydroxyethyl)phenyl]methanesulfonamide
CID 117306913
N-[2-(bromomethyl)phenyl]methanesulfonamide
CID 114296091
N-[[2-(diethylaminomethyl)phenyl]methyl]-2-[2-(methanesulfonamido)phenyl]acetamide
CID 86934936
N-[2-(cyclohexen-1-yl)ethyl]-2-[2-(methanesulfonamido)phenyl]acetamide
CID 56786800
[2-(methanesulfonamido)phenyl]methanesulfonamide
CID 170547357
2-[2-[[3-(methoxymethyl)phenyl]sulfonylamino]phenyl]-N-methylacetamide
CID 166186381
N-methyl-2-[2-(3-methylbutan-2-ylamino)phenyl]acetamide
CID 43692244
2-[2-(heptylamino)phenyl]-N-methylacetamide
CID 43692231
2-amino-3-[2-(methanesulfonamido)phenyl]propanoic acid
CID 22395840

Frequently Asked Questions

What is the IUPAC name of 2-[2-(methanesulfonamido)phenyl]-N-methylacetamide?
The IUPAC name of 2-[2-(methanesulfonamido)phenyl]-N-methylacetamide (CID 61061403) is 2-[2-(methanesulfonamido)phenyl]-N-methylacetamide.
What is the SMILES notation for 2-[2-(methanesulfonamido)phenyl]-N-methylacetamide?
The canonical SMILES for 2-[2-(methanesulfonamido)phenyl]-N-methylacetamide is CNC(=O)Cc1ccccc1NS(C)(=O)=O.
What is the InChIKey of 2-[2-(methanesulfonamido)phenyl]-N-methylacetamide?
The InChIKey is QPJRTLATUPIFHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O3S/c1-11-10(13)7-8-5-3-4-6-9(8)12-16(2,14)15/h3-6,12H,7H2,1-2H3,(H,11,13).
What are the key properties of 2-[2-(methanesulfonamido)phenyl]-N-methylacetamide?
2-[2-(methanesulfonamido)phenyl]-N-methylacetamide has a molecular weight of 242.30 g/mol, XLogP of 0.35, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(methanesulfonamido)phenyl]-N-methylacetamide is sourced from PubChem (CID 61061403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).