2-(2-methylsulfonylanilino)propanamide

C10H14N2O3S — CID 43402598

IUPAC2-(2-methylsulfonylanilino)propanamide
SMILESCC(Nc1ccccc1S(C)(=O)=O)C(N)=O
InChIInChI=1S/C10H14N2O3S/c1-7(10(11)13)12-8-5-3-4-6-9(8)16(2,14)15/h3-7,12H,1-2H3,(H2,11,13)
InChIKeyRSDJYTCKACAMCS-UHFFFAOYSA-N
MW242.30 g/mol
LogP0.38
Rot. Bonds4

About 2-(2-methylsulfonylanilino)propanamide

2-(2-methylsulfonylanilino)propanamide (PubChem CID 43402598) has the molecular formula C10H14N2O3S and a molecular weight of 242.30 g/mol. Its IUPAC name is 2-(2-methylsulfonylanilino)propanamide.

Molecular Properties

Compound Name2-(2-methylsulfonylanilino)propanamide
PubChem CID43402598
Molecular FormulaC10H14N2O3S
Molecular Weight242.30 g/mol
Exact Mass242.07
IUPAC Name2-(2-methylsulfonylanilino)propanamide
SMILESCC(Nc1ccccc1S(C)(=O)=O)C(N)=O
InChIInChI=1S/C10H14N2O3S/c1-7(10(11)13)12-8-5-3-4-6-9(8)16(2,14)15/h3-7,12H,1-2H3,(H2,11,13)
InChIKeyRSDJYTCKACAMCS-UHFFFAOYSA-N
XLogP0.38
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.30
LogP ≤ 50.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-N-(2-methylsulfonylphenyl)propanamide
CID 43424873
2-(2-sulfamoylanilino)propanoic acid
CID 43468805
ethyl 4-[2-(2-methylsulfonylanilino)propanoyl]piperazine-1-carboxylate
CID 22307253
2-[2-amino-3-(dimethylsulfamoyl)anilino]propanamide
CID 107115830
2-methylsulfonyl-N-(1-methylsulfonylpropan-2-yl)aniline
CID 64630343
methyl 2-(2-methylsulfonylanilino)butanoate
CID 113292467
2-methyl-2-(2-methylsulfonylanilino)propanamide
CID 61220583
N-[1-(2-methylphenyl)ethyl]-2-methylsulfonylaniline
CID 43233045
2-(2-methyl-3-sulfamoylanilino)propanoic acid
CID 66173145
2-(2-methylsulfonylanilino)-3-phenylpropanoic acid
CID 70086717
N-(2-methylpropyl)-2-methylsulfonylaniline
CID 43388031
2-amino-2-methyl-N-(2-methylsulfonylphenyl)propanamide
CID 61265607

Frequently Asked Questions

What is the IUPAC name of 2-(2-methylsulfonylanilino)propanamide?
The IUPAC name of 2-(2-methylsulfonylanilino)propanamide (CID 43402598) is 2-(2-methylsulfonylanilino)propanamide.
What is the SMILES notation for 2-(2-methylsulfonylanilino)propanamide?
The canonical SMILES for 2-(2-methylsulfonylanilino)propanamide is CC(Nc1ccccc1S(C)(=O)=O)C(N)=O.
What is the InChIKey of 2-(2-methylsulfonylanilino)propanamide?
The InChIKey is RSDJYTCKACAMCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O3S/c1-7(10(11)13)12-8-5-3-4-6-9(8)16(2,14)15/h3-7,12H,1-2H3,(H2,11,13).
What are the key properties of 2-(2-methylsulfonylanilino)propanamide?
2-(2-methylsulfonylanilino)propanamide has a molecular weight of 242.30 g/mol, XLogP of 0.38, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylsulfonylanilino)propanamide is sourced from PubChem (CID 43402598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).