N-[4-[(3,5-dimethylphenyl)sulfamoyl]phenyl]-2,2-dimethylpropanamide

C19H24N2O3S — CID 4927444

IUPACN-[4-[(3,5-dimethylphenyl)sulfamoyl]phenyl]-2,2-dimethylpropanamide
SMILESCc1cc(C)cc(NS(=O)(=O)c2ccc(NC(=O)C(C)(C)C)cc2)c1
InChIInChI=1S/C19H24N2O3S/c1-13-10-14(2)12-16(11-13)21-25(23,24)17-8-6-15(7-9-17)20-18(22)19(3,4)5/h6-12,21H,1-5H3,(H,20,22)
InChIKeyCSRDLRNJYWERBT-UHFFFAOYSA-N
MW360.48 g/mol
LogP4.09
Rot. Bonds4

About N-[4-[(3,5-dimethylphenyl)sulfamoyl]phenyl]-2,2-dimethylpropanamide

N-[4-[(3,5-dimethylphenyl)sulfamoyl]phenyl]-2,2-dimethylpropanamide (PubChem CID 4927444) has the molecular formula C19H24N2O3S and a molecular weight of 360.48 g/mol. Its IUPAC name is N-[4-[(3,5-dimethylphenyl)sulfamoyl]phenyl]-2,2-dimethylpropanamide.

Molecular Properties

Compound NameN-[4-[(3,5-dimethylphenyl)sulfamoyl]phenyl]-2,2-dimethylpropanamide
PubChem CID4927444
Molecular FormulaC19H24N2O3S
Molecular Weight360.48 g/mol
Exact Mass360.15
IUPAC NameN-[4-[(3,5-dimethylphenyl)sulfamoyl]phenyl]-2,2-dimethylpropanamide
SMILESCc1cc(C)cc(NS(=O)(=O)c2ccc(NC(=O)C(C)(C)C)cc2)c1
InChIInChI=1S/C19H24N2O3S/c1-13-10-14(2)12-16(11-13)21-25(23,24)17-8-6-15(7-9-17)20-18(22)19(3,4)5/h6-12,21H,1-5H3,(H,20,22)
InChIKeyCSRDLRNJYWERBT-UHFFFAOYSA-N
XLogP4.09
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.48
LogP ≤ 54.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-[(4-acetamidophenyl)sulfonylamino]phenyl]-2,2-dimethylpropanamide
CID 1026291
2,2-dimethyl-N-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]propanamide
CID 503706
N-[4-[(3-fluoro-5-methylphenyl)sulfamoyl]phenyl]acetamide
CID 97030412
N-[4-[(3,5-dimethylphenyl)sulfamoyl]phenyl]-3-methylbenzamide
CID 1013069
4-(benzenesulfonamido)-N-(3,5-dimethylphenyl)benzenesulfonamide
CID 3385972
4-[(3,5-dimethylphenyl)sulfamoyl]-N-phenylbenzamide
CID 109061613
1-(3-chlorophenyl)-3-[4-[(3,5-dimethylphenyl)sulfamoyl]phenyl]urea
CID 1226691
N-[4-(benzenesulfonamido)-2-methylphenyl]-2,2-dimethylpropanamide
CID 134878844
2,2-dimethyl-N-[4-[[4-[(6-methyl-2-pyridinyl)carbamoylamino]phenyl]sulfonylamino]phenyl]propanamide
CID 142036807
cis-(1S,2R)-2-[[4-[(3,5-dimethylphenyl)sulfamoyl]phenyl]carbamoyl]cyclohexane-1-carboxylate
CID 11918369
N-[4-[(3,5-dimethylphenyl)sulfamoyl]phenyl]-4-propan-2-yloxybenzamide
CID 4951888
4-[(3-fluoro-5-methylphenyl)sulfamoyl]benzoic acid
CID 79041528

Frequently Asked Questions

What is the IUPAC name of N-[4-[(3,5-dimethylphenyl)sulfamoyl]phenyl]-2,2-dimethylpropanamide?
The IUPAC name of N-[4-[(3,5-dimethylphenyl)sulfamoyl]phenyl]-2,2-dimethylpropanamide (CID 4927444) is N-[4-[(3,5-dimethylphenyl)sulfamoyl]phenyl]-2,2-dimethylpropanamide.
What is the SMILES notation for N-[4-[(3,5-dimethylphenyl)sulfamoyl]phenyl]-2,2-dimethylpropanamide?
The canonical SMILES for N-[4-[(3,5-dimethylphenyl)sulfamoyl]phenyl]-2,2-dimethylpropanamide is Cc1cc(C)cc(NS(=O)(=O)c2ccc(NC(=O)C(C)(C)C)cc2)c1.
What is the InChIKey of N-[4-[(3,5-dimethylphenyl)sulfamoyl]phenyl]-2,2-dimethylpropanamide?
The InChIKey is CSRDLRNJYWERBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O3S/c1-13-10-14(2)12-16(11-13)21-25(23,24)17-8-6-15(7-9-17)20-18(22)19(3,4)5/h6-12,21H,1-5H3,(H,20,22).
What are the key properties of N-[4-[(3,5-dimethylphenyl)sulfamoyl]phenyl]-2,2-dimethylpropanamide?
N-[4-[(3,5-dimethylphenyl)sulfamoyl]phenyl]-2,2-dimethylpropanamide has a molecular weight of 360.48 g/mol, XLogP of 4.09, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(3,5-dimethylphenyl)sulfamoyl]phenyl]-2,2-dimethylpropanamide is sourced from PubChem (CID 4927444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).