N-(2,4-dimethylphenyl)-3-(2-methyl-N-methylsulfonylanilino)propanamide

C19H24N2O3S — CID 113141664

IUPACN-(2,4-dimethylphenyl)-3-(2-methyl-N-methylsulfonylanilino)propanamide
SMILESCc1ccc(NC(=O)CCN(c2ccccc2C)S(C)(=O)=O)c(C)c1
InChIInChI=1S/C19H24N2O3S/c1-14-9-10-17(16(3)13-14)20-19(22)11-12-21(25(4,23)24)18-8-6-5-7-15(18)2/h5-10,13H,11-12H2,1-4H3,(H,20,22)
InChIKeyXYDYMFGIIZWCSO-UHFFFAOYSA-N
MW360.48 g/mol
LogP3.41
Rot. Bonds6

About N-(2,4-dimethylphenyl)-3-(2-methyl-N-methylsulfonylanilino)propanamide

N-(2,4-dimethylphenyl)-3-(2-methyl-N-methylsulfonylanilino)propanamide (PubChem CID 113141664) has the molecular formula C19H24N2O3S and a molecular weight of 360.48 g/mol. Its IUPAC name is N-(2,4-dimethylphenyl)-3-(2-methyl-N-methylsulfonylanilino)propanamide.

Molecular Properties

Compound NameN-(2,4-dimethylphenyl)-3-(2-methyl-N-methylsulfonylanilino)propanamide
PubChem CID113141664
Molecular FormulaC19H24N2O3S
Molecular Weight360.48 g/mol
Exact Mass360.15
IUPAC NameN-(2,4-dimethylphenyl)-3-(2-methyl-N-methylsulfonylanilino)propanamide
SMILESCc1ccc(NC(=O)CCN(c2ccccc2C)S(C)(=O)=O)c(C)c1
InChIInChI=1S/C19H24N2O3S/c1-14-9-10-17(16(3)13-14)20-19(22)11-12-21(25(4,23)24)18-8-6-5-7-15(18)2/h5-10,13H,11-12H2,1-4H3,(H,20,22)
InChIKeyXYDYMFGIIZWCSO-UHFFFAOYSA-N
XLogP3.41
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 ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(2,4-dimethylphenyl)-3-(2-methyl-N-methylsulfonylanilino)propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(4-chloro-2-methylphenyl)-3-(2-methyl-N-methylsulfonylanilino)propanamide
CID 113141688
3-(2,6-dimethyl-N-methylsulfonylanilino)-N-(2,4-dimethylphenyl)propanamide
CID 113142511
N-(4-chloro-2-methylphenyl)-3-(2,4-dimethyl-N-methylsulfonylanilino)propanamide
CID 113142091
3-(2,4-dimethyl-N-methylsulfonylanilino)-N-(2-fluorophenyl)propanamide
CID 113142084
2-(2,4-dimethyl-N-methylsulfonylanilino)-N-(2-methylphenyl)acetamide
CID 30168672
3-(4-chloro-2-methyl-N-methylsulfonylanilino)-N-(2-methylphenyl)propanamide
CID 113144144
N-(2,4-dimethylphenyl)-3-(N-methylsulfonyl-4-propan-2-ylanilino)propanamide
CID 113143094
N-(2,5-dimethoxyphenyl)-3-(2-methyl-N-methylsulfonylanilino)propanamide
CID 113141702
N-(4-chloro-2-methylphenyl)-3-(2-methoxy-N-methylsulfonylanilino)propanamide
CID 113144536
2-(2-chloro-N-methylsulfonylanilino)-N-(2,4-dimethylphenyl)acetamide
CID 51343170
N-(2,4-dimethylphenyl)-2-(2-methoxy-N-methylsulfonylanilino)acetamide
CID 1320489
N-(2,4-dimethylphenyl)-2-(N-methylsulfonylanilino)acetamide
CID 51343025

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dimethylphenyl)-3-(2-methyl-N-methylsulfonylanilino)propanamide?
The IUPAC name of N-(2,4-dimethylphenyl)-3-(2-methyl-N-methylsulfonylanilino)propanamide (CID 113141664) is N-(2,4-dimethylphenyl)-3-(2-methyl-N-methylsulfonylanilino)propanamide.
What is the SMILES notation for N-(2,4-dimethylphenyl)-3-(2-methyl-N-methylsulfonylanilino)propanamide?
The canonical SMILES for N-(2,4-dimethylphenyl)-3-(2-methyl-N-methylsulfonylanilino)propanamide is Cc1ccc(NC(=O)CCN(c2ccccc2C)S(C)(=O)=O)c(C)c1.
What is the InChIKey of N-(2,4-dimethylphenyl)-3-(2-methyl-N-methylsulfonylanilino)propanamide?
The InChIKey is XYDYMFGIIZWCSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O3S/c1-14-9-10-17(16(3)13-14)20-19(22)11-12-21(25(4,23)24)18-8-6-5-7-15(18)2/h5-10,13H,11-12H2,1-4H3,(H,20,22).
What are the key properties of N-(2,4-dimethylphenyl)-3-(2-methyl-N-methylsulfonylanilino)propanamide?
N-(2,4-dimethylphenyl)-3-(2-methyl-N-methylsulfonylanilino)propanamide has a molecular weight of 360.48 g/mol, XLogP of 3.41, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dimethylphenyl)-3-(2-methyl-N-methylsulfonylanilino)propanamide is sourced from PubChem (CID 113141664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).