2-methyl-5-[[2-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]sulfamoyl]benzamide

C17H16N4O4S — CID 60532014

IUPAC2-methyl-5-[[2-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]sulfamoyl]benzamide
SMILESCc1nnc(-c2ccccc2NS(=O)(=O)c2ccc(C)c(C(N)=O)c2)o1
InChIInChI=1S/C17H16N4O4S/c1-10-7-8-12(9-14(10)16(18)22)26(23,24)21-15-6-4-3-5-13(15)17-20-19-11(2)25-17/h3-9,21H,1-2H3,(H2,18,22)
InChIKeyYEZBEVYLKWSKQU-UHFFFAOYSA-N
MW372.41 g/mol
LogP2.25
Rot. Bonds5

About 2-methyl-5-[[2-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]sulfamoyl]benzamide

2-methyl-5-[[2-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]sulfamoyl]benzamide (PubChem CID 60532014) has the molecular formula C17H16N4O4S and a molecular weight of 372.41 g/mol. Its IUPAC name is 2-methyl-5-[[2-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]sulfamoyl]benzamide.

Molecular Properties

Compound Name2-methyl-5-[[2-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]sulfamoyl]benzamide
PubChem CID60532014
Molecular FormulaC17H16N4O4S
Molecular Weight372.41 g/mol
Exact Mass372.09
IUPAC Name2-methyl-5-[[2-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]sulfamoyl]benzamide
SMILESCc1nnc(-c2ccccc2NS(=O)(=O)c2ccc(C)c(C(N)=O)c2)o1
InChIInChI=1S/C17H16N4O4S/c1-10-7-8-12(9-14(10)16(18)22)26(23,24)21-15-6-4-3-5-13(15)17-20-19-11(2)25-17/h3-9,21H,1-2H3,(H2,18,22)
InChIKeyYEZBEVYLKWSKQU-UHFFFAOYSA-N
XLogP2.25
TPSA128.18 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.41
LogP ≤ 52.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

3-fluoro-4-methyl-N-[2-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]benzenesulfonamide
CID 60534651
2-methyl-5-(phenylsulfamoyl)benzamide
CID 870864
3-[[2-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]sulfamoyl]-N-(2,2,2-trifluoroethyl)benzamide
CID 55896243
2-methyl-5-[(2-methyl-3-pyridinyl)sulfamoyl]benzoic acid
CID 79042866
1-chloro-N-[2-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]methanesulfonamide
CID 63666407
5-[(4-bromo-2-fluorophenyl)sulfamoyl]-2-methylbenzamide
CID 2990334
N-(4-carbamoyl-3-methylphenyl)-2-methyl-5-[(2-methylphenyl)sulfamoyl]benzamide
CID 56527434
1-bromo-N-[2-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]methanesulfonamide
CID 83084278
2-methyl-5-[(5-methyl-1H-pyrazol-3-yl)sulfamoyl]benzamide
CID 63820783
3-amino-N-[2-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]propanamide
CID 43700063
4-[2-methyl-5-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]-N-[2-(4-sulfamoylphenyl)phenyl]benzamide
CID 10118990
5-[3-(aminomethyl)pentan-3-ylsulfamoyl]-2-methylbenzamide
CID 63888193

Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-[[2-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]sulfamoyl]benzamide?
The IUPAC name of 2-methyl-5-[[2-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]sulfamoyl]benzamide (CID 60532014) is 2-methyl-5-[[2-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]sulfamoyl]benzamide.
What is the SMILES notation for 2-methyl-5-[[2-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]sulfamoyl]benzamide?
The canonical SMILES for 2-methyl-5-[[2-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]sulfamoyl]benzamide is Cc1nnc(-c2ccccc2NS(=O)(=O)c2ccc(C)c(C(N)=O)c2)o1.
What is the InChIKey of 2-methyl-5-[[2-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]sulfamoyl]benzamide?
The InChIKey is YEZBEVYLKWSKQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N4O4S/c1-10-7-8-12(9-14(10)16(18)22)26(23,24)21-15-6-4-3-5-13(15)17-20-19-11(2)25-17/h3-9,21H,1-2H3,(H2,18,22).
What are the key properties of 2-methyl-5-[[2-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]sulfamoyl]benzamide?
2-methyl-5-[[2-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]sulfamoyl]benzamide has a molecular weight of 372.41 g/mol, XLogP of 2.25, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-[[2-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]sulfamoyl]benzamide is sourced from PubChem (CID 60532014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).