2-methyl-N-[(2-methylphenyl)methyl]-3-[(4-methylphenyl)sulfamoyl]propanamide

C19H24N2O3S — CID 110409028

IUPAC2-methyl-N-[(2-methylphenyl)methyl]-3-[(4-methylphenyl)sulfamoyl]propanamide
SMILESCc1ccc(NS(=O)(=O)CC(C)C(=O)NCc2ccccc2C)cc1
InChIInChI=1S/C19H24N2O3S/c1-14-8-10-18(11-9-14)21-25(23,24)13-16(3)19(22)20-12-17-7-5-4-6-15(17)2/h4-11,16,21H,12-13H2,1-3H3,(H,20,22)
InChIKeyHPHHOMPWUCWRSS-UHFFFAOYSA-N
MW360.48 g/mol
LogP3.00
Rot. Bonds7

About 2-methyl-N-[(2-methylphenyl)methyl]-3-[(4-methylphenyl)sulfamoyl]propanamide

2-methyl-N-[(2-methylphenyl)methyl]-3-[(4-methylphenyl)sulfamoyl]propanamide (PubChem CID 110409028) has the molecular formula C19H24N2O3S and a molecular weight of 360.48 g/mol. Its IUPAC name is 2-methyl-N-[(2-methylphenyl)methyl]-3-[(4-methylphenyl)sulfamoyl]propanamide.

Molecular Properties

Compound Name2-methyl-N-[(2-methylphenyl)methyl]-3-[(4-methylphenyl)sulfamoyl]propanamide
PubChem CID110409028
Molecular FormulaC19H24N2O3S
Molecular Weight360.48 g/mol
Exact Mass360.15
IUPAC Name2-methyl-N-[(2-methylphenyl)methyl]-3-[(4-methylphenyl)sulfamoyl]propanamide
SMILESCc1ccc(NS(=O)(=O)CC(C)C(=O)NCc2ccccc2C)cc1
InChIInChI=1S/C19H24N2O3S/c1-14-8-10-18(11-9-14)21-25(23,24)13-16(3)19(22)20-12-17-7-5-4-6-15(17)2/h4-11,16,21H,12-13H2,1-3H3,(H,20,22)
InChIKeyHPHHOMPWUCWRSS-UHFFFAOYSA-N
XLogP3.00
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.48
LogP ≤ 53.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(4-fluorophenyl)-2-oxoethyl]-2-methyl-3-[(4-methylphenyl)sulfamoyl]propanamide
CID 110607539
2-methyl-3-[(4-methylphenyl)sulfamoyl]-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]propanamide
CID 110620243
2-(4-methylphenoxy)-N-[(2-methylphenyl)methyl]propanamide
CID 46807295
2-methyl-N-[(2-methylphenyl)methyl]-3-phenylsulfanylpropanamide
CID 86933457
1-[(2-methylphenyl)methyl]-3-[(4-methylphenyl)methyl]urea
CID 47133695
N-[(2-fluorophenyl)methyl]-2-[4-[(4-methylphenyl)sulfonylamino]anilino]propanamide
CID 86918995
(2S)-2-amino-4-methyl-N-[(2-methylphenyl)methyl]pentanamide
CID 22691003
2-methyl-3-(4-methylphenyl)sulfonyl-N-phenylpropanamide
CID 10245288
2-[(2-chlorophenyl)methylsulfonyl]-N-[(2-methylphenyl)methyl]propanamide
CID 86923050
2-acetamido-3-methyl-N-[(2-methylphenyl)methyl]butanamide
CID 17395399
(2R)-N-[(2-methylphenyl)methyl]-2-phenoxypropanamide
CID 41013253
3-methyl-2-(methylaminomethyl)-N-[(2-methylphenyl)methyl]butanamide
CID 115187718

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[(2-methylphenyl)methyl]-3-[(4-methylphenyl)sulfamoyl]propanamide?
The IUPAC name of 2-methyl-N-[(2-methylphenyl)methyl]-3-[(4-methylphenyl)sulfamoyl]propanamide (CID 110409028) is 2-methyl-N-[(2-methylphenyl)methyl]-3-[(4-methylphenyl)sulfamoyl]propanamide.
What is the SMILES notation for 2-methyl-N-[(2-methylphenyl)methyl]-3-[(4-methylphenyl)sulfamoyl]propanamide?
The canonical SMILES for 2-methyl-N-[(2-methylphenyl)methyl]-3-[(4-methylphenyl)sulfamoyl]propanamide is Cc1ccc(NS(=O)(=O)CC(C)C(=O)NCc2ccccc2C)cc1.
What is the InChIKey of 2-methyl-N-[(2-methylphenyl)methyl]-3-[(4-methylphenyl)sulfamoyl]propanamide?
The InChIKey is HPHHOMPWUCWRSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O3S/c1-14-8-10-18(11-9-14)21-25(23,24)13-16(3)19(22)20-12-17-7-5-4-6-15(17)2/h4-11,16,21H,12-13H2,1-3H3,(H,20,22).
What are the key properties of 2-methyl-N-[(2-methylphenyl)methyl]-3-[(4-methylphenyl)sulfamoyl]propanamide?
2-methyl-N-[(2-methylphenyl)methyl]-3-[(4-methylphenyl)sulfamoyl]propanamide has a molecular weight of 360.48 g/mol, XLogP of 3.00, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[(2-methylphenyl)methyl]-3-[(4-methylphenyl)sulfamoyl]propanamide is sourced from PubChem (CID 110409028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).