2-(2-methyl-N-methylsulfonylanilino)-N-(2-propan-2-ylphenyl)acetamide

C19H24N2O3S — CID 1317403

IUPAC2-(2-methyl-N-methylsulfonylanilino)-N-(2-propan-2-ylphenyl)acetamide
SMILESCc1ccccc1N(CC(=O)Nc1ccccc1C(C)C)S(C)(=O)=O
InChIInChI=1S/C19H24N2O3S/c1-14(2)16-10-6-7-11-17(16)20-19(22)13-21(25(4,23)24)18-12-8-5-9-15(18)3/h5-12,14H,13H2,1-4H3,(H,20,22)
InChIKeyKLYZAPBEUZXJLX-UHFFFAOYSA-N
MW360.48 g/mol
LogP3.52
Rot. Bonds6

About 2-(2-methyl-N-methylsulfonylanilino)-N-(2-propan-2-ylphenyl)acetamide

2-(2-methyl-N-methylsulfonylanilino)-N-(2-propan-2-ylphenyl)acetamide (PubChem CID 1317403) has the molecular formula C19H24N2O3S and a molecular weight of 360.48 g/mol. Its IUPAC name is 2-(2-methyl-N-methylsulfonylanilino)-N-(2-propan-2-ylphenyl)acetamide.

Molecular Properties

Compound Name2-(2-methyl-N-methylsulfonylanilino)-N-(2-propan-2-ylphenyl)acetamide
PubChem CID1317403
Molecular FormulaC19H24N2O3S
Molecular Weight360.48 g/mol
Exact Mass360.15
IUPAC Name2-(2-methyl-N-methylsulfonylanilino)-N-(2-propan-2-ylphenyl)acetamide
SMILESCc1ccccc1N(CC(=O)Nc1ccccc1C(C)C)S(C)(=O)=O
InChIInChI=1S/C19H24N2O3S/c1-14(2)16-10-6-7-11-17(16)20-19(22)13-21(25(4,23)24)18-12-8-5-9-15(18)3/h5-12,14H,13H2,1-4H3,(H,20,22)
InChIKeyKLYZAPBEUZXJLX-UHFFFAOYSA-N
XLogP3.52
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.48
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-methylphenyl)-2-(N-methylsulfonyl-2-propan-2-ylanilino)acetamide
CID 30257850
2-[N-(benzenesulfonyl)-2-methylanilino]-N-(2-propan-2-ylphenyl)acetamide
CID 2111548
N-(2,3-dimethylphenyl)-2-(N-methylsulfonyl-2-propan-2-ylanilino)acetamide
CID 30262005
N-(2-propan-2-ylphenyl)-2-(2,4,6-trimethyl-N-methylsulfonylanilino)acetamide
CID 30268728
2-(N-methylsulfonylanilino)-N-(2-propan-2-ylphenyl)acetamide
CID 113153663
N-(2,6-dimethylphenyl)-2-(N-methylsulfonyl-2-propan-2-ylanilino)acetamide
CID 30258400
2-(2-methyl-N-methylsulfonylanilino)-N-naphthalen-1-ylacetamide
CID 1372880
2-(N-acetyl-2-methylanilino)-N-(2-propan-2-ylphenyl)acetamide
CID 113167364
N-[(2S)-butan-2-yl]-2-[[2-(2-methyl-N-methylsulfonylanilino)acetyl]amino]benzamide
CID 126118433
N-(4-iodo-2-methylphenyl)-2-(N-methylsulfonyl-2-propan-2-ylanilino)acetamide
CID 30268575
N-[2-(N-methylanilino)phenyl]-2-(2-methyl-N-methylsulfonylanilino)acetamide
CID 55726000
2-(N-methylsulfonyl-2-propan-2-ylanilino)-N-phenylacetamide
CID 30257747

Frequently Asked Questions

What is the IUPAC name of 2-(2-methyl-N-methylsulfonylanilino)-N-(2-propan-2-ylphenyl)acetamide?
The IUPAC name of 2-(2-methyl-N-methylsulfonylanilino)-N-(2-propan-2-ylphenyl)acetamide (CID 1317403) is 2-(2-methyl-N-methylsulfonylanilino)-N-(2-propan-2-ylphenyl)acetamide.
What is the SMILES notation for 2-(2-methyl-N-methylsulfonylanilino)-N-(2-propan-2-ylphenyl)acetamide?
The canonical SMILES for 2-(2-methyl-N-methylsulfonylanilino)-N-(2-propan-2-ylphenyl)acetamide is Cc1ccccc1N(CC(=O)Nc1ccccc1C(C)C)S(C)(=O)=O.
What is the InChIKey of 2-(2-methyl-N-methylsulfonylanilino)-N-(2-propan-2-ylphenyl)acetamide?
The InChIKey is KLYZAPBEUZXJLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O3S/c1-14(2)16-10-6-7-11-17(16)20-19(22)13-21(25(4,23)24)18-12-8-5-9-15(18)3/h5-12,14H,13H2,1-4H3,(H,20,22).
What are the key properties of 2-(2-methyl-N-methylsulfonylanilino)-N-(2-propan-2-ylphenyl)acetamide?
2-(2-methyl-N-methylsulfonylanilino)-N-(2-propan-2-ylphenyl)acetamide has a molecular weight of 360.48 g/mol, XLogP of 3.52, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methyl-N-methylsulfonylanilino)-N-(2-propan-2-ylphenyl)acetamide is sourced from PubChem (CID 1317403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).