N-(2-methyl-3-sulfamoylphenyl)-1,2-oxazole-5-carboxamide

C11H11N3O4S — CID 61130286

IUPACN-(2-methyl-3-sulfamoylphenyl)-1,2-oxazole-5-carboxamide
SMILESCc1c(NC(=O)c2ccno2)cccc1S(N)(=O)=O
InChIInChI=1S/C11H11N3O4S/c1-7-8(3-2-4-10(7)19(12,16)17)14-11(15)9-5-6-13-18-9/h2-6H,1H3,(H,14,15)(H2,12,16,17)
InChIKeyWRRSGJLRVQDAQB-UHFFFAOYSA-N
MW281.29 g/mol
LogP0.88
Rot. Bonds3

About N-(2-methyl-3-sulfamoylphenyl)-1,2-oxazole-5-carboxamide

N-(2-methyl-3-sulfamoylphenyl)-1,2-oxazole-5-carboxamide (PubChem CID 61130286) has the molecular formula C11H11N3O4S and a molecular weight of 281.29 g/mol. Its IUPAC name is N-(2-methyl-3-sulfamoylphenyl)-1,2-oxazole-5-carboxamide.

Molecular Properties

Compound NameN-(2-methyl-3-sulfamoylphenyl)-1,2-oxazole-5-carboxamide
PubChem CID61130286
Molecular FormulaC11H11N3O4S
Molecular Weight281.29 g/mol
Exact Mass281.05
IUPAC NameN-(2-methyl-3-sulfamoylphenyl)-1,2-oxazole-5-carboxamide
SMILESCc1c(NC(=O)c2ccno2)cccc1S(N)(=O)=O
InChIInChI=1S/C11H11N3O4S/c1-7-8(3-2-4-10(7)19(12,16)17)14-11(15)9-5-6-13-18-9/h2-6H,1H3,(H,14,15)(H2,12,16,17)
InChIKeyWRRSGJLRVQDAQB-UHFFFAOYSA-N
XLogP0.88
TPSA115.29 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.29
LogP ≤ 50.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-fluoro-N-(2-methyl-3-sulfamoylphenyl)benzamide
CID 61036384
2-fluoro-N-(2-methyl-3-sulfamoylphenyl)pyridine-4-carboxamide
CID 61293813
6-methyl-N-(2-methyl-3-sulfamoylphenyl)pyridine-2-carboxamide
CID 61129334
4-iodo-N-(2-methyl-3-sulfamoylphenyl)benzamide
CID 61034623
N-(2-chloro-5-sulfamoylphenyl)-1,2-oxazole-5-carboxamide
CID 61131080
2-(2-methyl-3-sulfamoylanilino)propanoic acid
CID 66173145
tert-butyl N-(2-methyl-3-sulfamoylphenyl)carbamate
CID 65142606
N-(2-methyl-3-sulfamoylphenyl)-2-(propan-2-ylamino)acetamide
CID 54863561
N-(3,5-dichloro-2-hydroxy-4-methylphenyl)-1,2-oxazole-5-carboxamide
CID 23566060
2-methyl-3-(methylamino)-N-(2-methyl-3-sulfamoylphenyl)propanamide
CID 79196365
5-methoxy-2-methyl-N-(2-methyl-3-sulfamoylphenyl)benzamide
CID 126612439
methyl N-[(2-methyl-3-sulfamoylphenyl)sulfamoyl]carbamate
CID 114465998

Frequently Asked Questions

What is the IUPAC name of N-(2-methyl-3-sulfamoylphenyl)-1,2-oxazole-5-carboxamide?
The IUPAC name of N-(2-methyl-3-sulfamoylphenyl)-1,2-oxazole-5-carboxamide (CID 61130286) is N-(2-methyl-3-sulfamoylphenyl)-1,2-oxazole-5-carboxamide.
What is the SMILES notation for N-(2-methyl-3-sulfamoylphenyl)-1,2-oxazole-5-carboxamide?
The canonical SMILES for N-(2-methyl-3-sulfamoylphenyl)-1,2-oxazole-5-carboxamide is Cc1c(NC(=O)c2ccno2)cccc1S(N)(=O)=O.
What is the InChIKey of N-(2-methyl-3-sulfamoylphenyl)-1,2-oxazole-5-carboxamide?
The InChIKey is WRRSGJLRVQDAQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N3O4S/c1-7-8(3-2-4-10(7)19(12,16)17)14-11(15)9-5-6-13-18-9/h2-6H,1H3,(H,14,15)(H2,12,16,17).
What are the key properties of N-(2-methyl-3-sulfamoylphenyl)-1,2-oxazole-5-carboxamide?
N-(2-methyl-3-sulfamoylphenyl)-1,2-oxazole-5-carboxamide has a molecular weight of 281.29 g/mol, XLogP of 0.88, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyl-3-sulfamoylphenyl)-1,2-oxazole-5-carboxamide is sourced from PubChem (CID 61130286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).