2-(3,4-dimethylphenyl)-N-[4-[methyl(propan-2-yl)sulfamoyl]phenyl]acetamide

C20H26N2O3S — CID 8759555

IUPAC2-(3,4-dimethylphenyl)-N-[4-[methyl(propan-2-yl)sulfamoyl]phenyl]acetamide
SMILESCc1ccc(CC(=O)Nc2ccc(S(=O)(=O)N(C)C(C)C)cc2)cc1C
InChIInChI=1S/C20H26N2O3S/c1-14(2)22(5)26(24,25)19-10-8-18(9-11-19)21-20(23)13-17-7-6-15(3)16(4)12-17/h6-12,14H,13H2,1-5H3,(H,21,23)
InChIKeyLWCHCDHWNUAXET-UHFFFAOYSA-N
MW374.51 g/mol
LogP3.51
Rot. Bonds6

About 2-(3,4-dimethylphenyl)-N-[4-[methyl(propan-2-yl)sulfamoyl]phenyl]acetamide

2-(3,4-dimethylphenyl)-N-[4-[methyl(propan-2-yl)sulfamoyl]phenyl]acetamide (PubChem CID 8759555) has the molecular formula C20H26N2O3S and a molecular weight of 374.51 g/mol. Its IUPAC name is 2-(3,4-dimethylphenyl)-N-[4-[methyl(propan-2-yl)sulfamoyl]phenyl]acetamide.

Molecular Properties

Compound Name2-(3,4-dimethylphenyl)-N-[4-[methyl(propan-2-yl)sulfamoyl]phenyl]acetamide
PubChem CID8759555
Molecular FormulaC20H26N2O3S
Molecular Weight374.51 g/mol
Exact Mass374.17
IUPAC Name2-(3,4-dimethylphenyl)-N-[4-[methyl(propan-2-yl)sulfamoyl]phenyl]acetamide
SMILESCc1ccc(CC(=O)Nc2ccc(S(=O)(=O)N(C)C(C)C)cc2)cc1C
InChIInChI=1S/C20H26N2O3S/c1-14(2)22(5)26(24,25)19-10-8-18(9-11-19)21-20(23)13-17-7-6-15(3)16(4)12-17/h6-12,14H,13H2,1-5H3,(H,21,23)
InChIKeyLWCHCDHWNUAXET-UHFFFAOYSA-N
XLogP3.51
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.51
LogP ≤ 53.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3,4-dimethylphenyl)-N-[4-(dimethylsulfamoyl)phenyl]acetamide
CID 2672838
2-(4-methylphenyl)-N-[4-[methyl(propan-2-yl)sulfamoyl]phenyl]acetamide
CID 9224098
2-(2,3-dihydro-1-benzofuran-5-yl)-N-[4-[methyl(propan-2-yl)sulfamoyl]phenyl]acetamide
CID 51313250
N-[4-[methyl(propan-2-yl)sulfamoyl]phenyl]-2-[3-(trifluoromethyl)phenyl]acetamide
CID 8759670
N-(3,4-dimethylphenyl)-4-[methyl(propan-2-yl)sulfamoyl]benzamide
CID 51297168
2-(3,4-dimethylphenyl)-N-(4-methylphenyl)acetamide
CID 2664751
N,2-bis(3,4-dimethylphenyl)acetamide
CID 2600237
2-[4-[methyl(propan-2-yl)sulfamoyl]anilino]-N-phenylacetamide
CID 24616722
2-(6-ethyl-1-benzofuran-3-yl)-N-[4-[methyl(propan-2-yl)sulfamoyl]phenyl]acetamide
CID 9219883
2-(3,4-dimethylphenyl)-N-(4-formylphenyl)acetamide
CID 106912167
2-(5,7-dimethyl-2-oxo-1H-pyrazolo[1,5-a]pyrimidin-6-yl)-N-[4-[methyl(propan-2-yl)sulfamoyl]phenyl]acetamide
CID 56531921
N-[4-[methyl(propan-2-yl)sulfamoyl]phenyl]-2-(2-propan-2-yl-1,3-thiazol-4-yl)acetamide
CID 38921105

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dimethylphenyl)-N-[4-[methyl(propan-2-yl)sulfamoyl]phenyl]acetamide?
The IUPAC name of 2-(3,4-dimethylphenyl)-N-[4-[methyl(propan-2-yl)sulfamoyl]phenyl]acetamide (CID 8759555) is 2-(3,4-dimethylphenyl)-N-[4-[methyl(propan-2-yl)sulfamoyl]phenyl]acetamide.
What is the SMILES notation for 2-(3,4-dimethylphenyl)-N-[4-[methyl(propan-2-yl)sulfamoyl]phenyl]acetamide?
The canonical SMILES for 2-(3,4-dimethylphenyl)-N-[4-[methyl(propan-2-yl)sulfamoyl]phenyl]acetamide is Cc1ccc(CC(=O)Nc2ccc(S(=O)(=O)N(C)C(C)C)cc2)cc1C.
What is the InChIKey of 2-(3,4-dimethylphenyl)-N-[4-[methyl(propan-2-yl)sulfamoyl]phenyl]acetamide?
The InChIKey is LWCHCDHWNUAXET-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O3S/c1-14(2)22(5)26(24,25)19-10-8-18(9-11-19)21-20(23)13-17-7-6-15(3)16(4)12-17/h6-12,14H,13H2,1-5H3,(H,21,23).
What are the key properties of 2-(3,4-dimethylphenyl)-N-[4-[methyl(propan-2-yl)sulfamoyl]phenyl]acetamide?
2-(3,4-dimethylphenyl)-N-[4-[methyl(propan-2-yl)sulfamoyl]phenyl]acetamide has a molecular weight of 374.51 g/mol, XLogP of 3.51, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-dimethylphenyl)-N-[4-[methyl(propan-2-yl)sulfamoyl]phenyl]acetamide is sourced from PubChem (CID 8759555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).