N-[2,4-dimethoxy-5-[methyl(phenyl)sulfamoyl]phenyl]acetamide

C17H20N2O5S — CID 57391458

IUPACN-[2,4-dimethoxy-5-[methyl(phenyl)sulfamoyl]phenyl]acetamide
SMILESCOc1cc(OC)c(S(=O)(=O)N(C)c2ccccc2)cc1NC(C)=O
InChIInChI=1S/C17H20N2O5S/c1-12(20)18-14-10-17(16(24-4)11-15(14)23-3)25(21,22)19(2)13-8-6-5-7-9-13/h5-11H,1-4H3,(H,18,20)
InChIKeyVLBXOYVWEBHPSO-UHFFFAOYSA-N
MW364.42 g/mol
LogP2.49
Rot. Bonds6

About N-[2,4-dimethoxy-5-[methyl(phenyl)sulfamoyl]phenyl]acetamide

N-[2,4-dimethoxy-5-[methyl(phenyl)sulfamoyl]phenyl]acetamide (PubChem CID 57391458) has the molecular formula C17H20N2O5S and a molecular weight of 364.42 g/mol. Its IUPAC name is N-[2,4-dimethoxy-5-[methyl(phenyl)sulfamoyl]phenyl]acetamide.

Molecular Properties

Compound NameN-[2,4-dimethoxy-5-[methyl(phenyl)sulfamoyl]phenyl]acetamide
PubChem CID57391458
Molecular FormulaC17H20N2O5S
Molecular Weight364.42 g/mol
Exact Mass364.11
IUPAC NameN-[2,4-dimethoxy-5-[methyl(phenyl)sulfamoyl]phenyl]acetamide
SMILESCOc1cc(OC)c(S(=O)(=O)N(C)c2ccccc2)cc1NC(C)=O
InChIInChI=1S/C17H20N2O5S/c1-12(20)18-14-10-17(16(24-4)11-15(14)23-3)25(21,22)19(2)13-8-6-5-7-9-13/h5-11H,1-4H3,(H,18,20)
InChIKeyVLBXOYVWEBHPSO-UHFFFAOYSA-N
XLogP2.49
TPSA84.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.42
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[2,4-dimethoxy-5-[methyl(phenyl)sulfamoyl]phenyl]acetamide?
The IUPAC name of N-[2,4-dimethoxy-5-[methyl(phenyl)sulfamoyl]phenyl]acetamide (CID 57391458) is N-[2,4-dimethoxy-5-[methyl(phenyl)sulfamoyl]phenyl]acetamide.
What is the SMILES notation for N-[2,4-dimethoxy-5-[methyl(phenyl)sulfamoyl]phenyl]acetamide?
The canonical SMILES for N-[2,4-dimethoxy-5-[methyl(phenyl)sulfamoyl]phenyl]acetamide is COc1cc(OC)c(S(=O)(=O)N(C)c2ccccc2)cc1NC(C)=O.
What is the InChIKey of N-[2,4-dimethoxy-5-[methyl(phenyl)sulfamoyl]phenyl]acetamide?
The InChIKey is VLBXOYVWEBHPSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O5S/c1-12(20)18-14-10-17(16(24-4)11-15(14)23-3)25(21,22)19(2)13-8-6-5-7-9-13/h5-11H,1-4H3,(H,18,20).
What are the key properties of N-[2,4-dimethoxy-5-[methyl(phenyl)sulfamoyl]phenyl]acetamide?
N-[2,4-dimethoxy-5-[methyl(phenyl)sulfamoyl]phenyl]acetamide has a molecular weight of 364.42 g/mol, XLogP of 2.49, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2,4-dimethoxy-5-[methyl(phenyl)sulfamoyl]phenyl]acetamide is sourced from PubChem (CID 57391458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).