N-(2-methylphenyl)-3-[(4-methylphenyl)sulfonylamino]propanamide

C17H20N2O3S — CID 17154113

IUPACN-(2-methylphenyl)-3-[(4-methylphenyl)sulfonylamino]propanamide
SMILESCc1ccc(S(=O)(=O)NCCC(=O)Nc2ccccc2C)cc1
InChIInChI=1S/C17H20N2O3S/c1-13-7-9-15(10-8-13)23(21,22)18-12-11-17(20)19-16-6-4-3-5-14(16)2/h3-10,18H,11-12H2,1-2H3,(H,19,20)
InChIKeyZQFIZPCVSZEXMB-UHFFFAOYSA-N
MW332.43 g/mol
LogP2.61
Rot. Bonds6

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

N-(2-methylphenyl)-3-[(4-methylphenyl)sulfonylamino]propanamide (PubChem CID 17154113) has the molecular formula C17H20N2O3S and a molecular weight of 332.43 g/mol. Its IUPAC name is N-(2-methylphenyl)-3-[(4-methylphenyl)sulfonylamino]propanamide.

Molecular Properties

Compound NameN-(2-methylphenyl)-3-[(4-methylphenyl)sulfonylamino]propanamide
PubChem CID17154113
Molecular FormulaC17H20N2O3S
Molecular Weight332.43 g/mol
Exact Mass332.12
IUPAC NameN-(2-methylphenyl)-3-[(4-methylphenyl)sulfonylamino]propanamide
SMILESCc1ccc(S(=O)(=O)NCCC(=O)Nc2ccccc2C)cc1
InChIInChI=1S/C17H20N2O3S/c1-13-7-9-15(10-8-13)23(21,22)18-12-11-17(20)19-16-6-4-3-5-14(16)2/h3-10,18H,11-12H2,1-2H3,(H,19,20)
InChIKeyZQFIZPCVSZEXMB-UHFFFAOYSA-N
XLogP2.61
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.43
LogP ≤ 52.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,4-dimethylphenyl)-3-[(4-methylphenyl)sulfonylamino]propanamide
CID 4986521
3-(benzenesulfonamido)-N-[2-(4-methylbenzoyl)phenyl]propanamide
CID 86807944
N-[(4-methylphenyl)methyl]-2-[3-[(4-methylphenyl)sulfonylamino]propanoylamino]benzamide
CID 17154248
N-(4-anilinophenyl)-3-[(4-methylphenyl)sulfonylamino]propanamide
CID 46554404
2-[4-(ethylsulfamoyl)phenyl]-N-(2-methylphenyl)acetamide
CID 75506253
N-benzyl-N-methyl-2-[3-[(4-methylphenyl)sulfonylamino]propanoylamino]benzamide
CID 17154235
3-(benzenesulfonamido)-N-(4-chloro-2-methylphenyl)propanamide
CID 26687749
2-[(4-bromophenyl)sulfonylamino]-N-(2-methylphenyl)acetamide
CID 1316963
3-[(3,4-difluorophenyl)sulfonylamino]-N-(2,5-dimethylphenyl)propanamide
CID 26500090
N-(2,3-dimethylphenyl)-3-[(4-ethoxyphenyl)sulfonylamino]propanamide
CID 26538586
3-[(4-fluorophenyl)sulfonylamino]-N-(4-methylphenyl)propanamide
CID 9452229
2-[(4-ethylphenyl)sulfonylamino]-N-(2-methylphenyl)acetamide
CID 112996082

Frequently Asked Questions

What is the IUPAC name of N-(2-methylphenyl)-3-[(4-methylphenyl)sulfonylamino]propanamide?
The IUPAC name of N-(2-methylphenyl)-3-[(4-methylphenyl)sulfonylamino]propanamide (CID 17154113) is N-(2-methylphenyl)-3-[(4-methylphenyl)sulfonylamino]propanamide.
What is the SMILES notation for N-(2-methylphenyl)-3-[(4-methylphenyl)sulfonylamino]propanamide?
The canonical SMILES for N-(2-methylphenyl)-3-[(4-methylphenyl)sulfonylamino]propanamide is Cc1ccc(S(=O)(=O)NCCC(=O)Nc2ccccc2C)cc1.
What is the InChIKey of N-(2-methylphenyl)-3-[(4-methylphenyl)sulfonylamino]propanamide?
The InChIKey is ZQFIZPCVSZEXMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O3S/c1-13-7-9-15(10-8-13)23(21,22)18-12-11-17(20)19-16-6-4-3-5-14(16)2/h3-10,18H,11-12H2,1-2H3,(H,19,20).
What are the key properties of N-(2-methylphenyl)-3-[(4-methylphenyl)sulfonylamino]propanamide?
N-(2-methylphenyl)-3-[(4-methylphenyl)sulfonylamino]propanamide has a molecular weight of 332.43 g/mol, XLogP of 2.61, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylphenyl)-3-[(4-methylphenyl)sulfonylamino]propanamide is sourced from PubChem (CID 17154113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).