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

C16H18N2O5S — CID 57398472

IUPACN-[2,4-dimethoxy-5-(phenylsulfamoyl)phenyl]acetamide
SMILESCOc1cc(OC)c(S(=O)(=O)Nc2ccccc2)cc1NC(C)=O
InChIInChI=1S/C16H18N2O5S/c1-11(19)17-13-9-16(15(23-3)10-14(13)22-2)24(20,21)18-12-7-5-4-6-8-12/h4-10,18H,1-3H3,(H,17,19)
InChIKeyLJZJFOIFDKKIFD-UHFFFAOYSA-N
MW350.40 g/mol
LogP2.46
Rot. Bonds6

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

N-[2,4-dimethoxy-5-(phenylsulfamoyl)phenyl]acetamide (PubChem CID 57398472) has the molecular formula C16H18N2O5S and a molecular weight of 350.40 g/mol. Its IUPAC name is N-[2,4-dimethoxy-5-(phenylsulfamoyl)phenyl]acetamide.

Molecular Properties

Compound NameN-[2,4-dimethoxy-5-(phenylsulfamoyl)phenyl]acetamide
PubChem CID57398472
Molecular FormulaC16H18N2O5S
Molecular Weight350.40 g/mol
Exact Mass350.09
IUPAC NameN-[2,4-dimethoxy-5-(phenylsulfamoyl)phenyl]acetamide
SMILESCOc1cc(OC)c(S(=O)(=O)Nc2ccccc2)cc1NC(C)=O
InChIInChI=1S/C16H18N2O5S/c1-11(19)17-13-9-16(15(23-3)10-14(13)22-2)24(20,21)18-12-7-5-4-6-8-12/h4-10,18H,1-3H3,(H,17,19)
InChIKeyLJZJFOIFDKKIFD-UHFFFAOYSA-N
XLogP2.46
TPSA93.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.40
LogP ≤ 52.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[2,4-dimethoxy-5-(phenylsulfamoyl)phenyl]acetamide?
The IUPAC name of N-[2,4-dimethoxy-5-(phenylsulfamoyl)phenyl]acetamide (CID 57398472) is N-[2,4-dimethoxy-5-(phenylsulfamoyl)phenyl]acetamide.
What is the SMILES notation for N-[2,4-dimethoxy-5-(phenylsulfamoyl)phenyl]acetamide?
The canonical SMILES for N-[2,4-dimethoxy-5-(phenylsulfamoyl)phenyl]acetamide is COc1cc(OC)c(S(=O)(=O)Nc2ccccc2)cc1NC(C)=O.
What is the InChIKey of N-[2,4-dimethoxy-5-(phenylsulfamoyl)phenyl]acetamide?
The InChIKey is LJZJFOIFDKKIFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O5S/c1-11(19)17-13-9-16(15(23-3)10-14(13)22-2)24(20,21)18-12-7-5-4-6-8-12/h4-10,18H,1-3H3,(H,17,19).
What are the key properties of N-[2,4-dimethoxy-5-(phenylsulfamoyl)phenyl]acetamide?
N-[2,4-dimethoxy-5-(phenylsulfamoyl)phenyl]acetamide has a molecular weight of 350.40 g/mol, XLogP of 2.46, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2,4-dimethoxy-5-(phenylsulfamoyl)phenyl]acetamide is sourced from PubChem (CID 57398472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).