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

C11H10ClN3O4S — CID 61128987

IUPACN-(2-chloro-5-sulfamoylphenyl)-5-methyl-1,2-oxazole-3-carboxamide
SMILESCc1cc(C(=O)Nc2cc(S(N)(=O)=O)ccc2Cl)no1
InChIInChI=1S/C11H10ClN3O4S/c1-6-4-10(15-19-6)11(16)14-9-5-7(20(13,17)18)2-3-8(9)12/h2-5H,1H3,(H,14,16)(H2,13,17,18)
InChIKeyFLIXMCXPTQXVGX-UHFFFAOYSA-N
MW315.74 g/mol
LogP1.54
Rot. Bonds3

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

N-(2-chloro-5-sulfamoylphenyl)-5-methyl-1,2-oxazole-3-carboxamide (PubChem CID 61128987) has the molecular formula C11H10ClN3O4S and a molecular weight of 315.74 g/mol. Its IUPAC name is N-(2-chloro-5-sulfamoylphenyl)-5-methyl-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound NameN-(2-chloro-5-sulfamoylphenyl)-5-methyl-1,2-oxazole-3-carboxamide
PubChem CID61128987
Molecular FormulaC11H10ClN3O4S
Molecular Weight315.74 g/mol
Exact Mass315.01
IUPAC NameN-(2-chloro-5-sulfamoylphenyl)-5-methyl-1,2-oxazole-3-carboxamide
SMILESCc1cc(C(=O)Nc2cc(S(N)(=O)=O)ccc2Cl)no1
InChIInChI=1S/C11H10ClN3O4S/c1-6-4-10(15-19-6)11(16)14-9-5-7(20(13,17)18)2-3-8(9)12/h2-5H,1H3,(H,14,16)(H2,13,17,18)
InChIKeyFLIXMCXPTQXVGX-UHFFFAOYSA-N
XLogP1.54
TPSA115.29 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.74
LogP ≤ 51.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-chloro-5-sulfamoylphenyl)-1,2-oxazole-5-carboxamide
CID 61131080
N-(2-chloro-5-sulfamoylphenyl)-2-methylpyrazole-3-carboxamide
CID 61131082
N-(2-chloro-5-sulfamoylphenyl)propanamide
CID 61130694
3-fluoro-4-[(5-methyl-1,2-oxazole-3-carbonyl)amino]benzenesulfonyl chloride
CID 66156540
5-chloro-N-(2-chloro-5-sulfamoylphenyl)thiophene-2-carboxamide
CID 62276709
(2S)-2-amino-N-(2-chloro-5-sulfamoylphenyl)-3-methylbutanamide
CID 61178070
6-chloro-N-(2-methyl-5-sulfamoylphenyl)pyridazine-3-carboxamide
CID 61052794
4,5-dibromo-N-(2-chloro-5-sulfamoylphenyl)thiophene-2-carboxamide
CID 80534332
N-(2-bromo-4-methylphenyl)-5-methyl-1,2-oxazole-3-carboxamide
CID 17173642
N-(4-chloro-2-iodophenyl)-5-methyl-1,2-oxazole-3-carboxamide
CID 103766897
2-amino-N-[2-(2-chloro-5-sulfamoylanilino)-2-oxoethyl]acetamide
CID 60849966
3-amino-N-(2-chloro-5-sulfamoylphenyl)butanamide
CID 54924131

Frequently Asked Questions

What is the IUPAC name of N-(2-chloro-5-sulfamoylphenyl)-5-methyl-1,2-oxazole-3-carboxamide?
The IUPAC name of N-(2-chloro-5-sulfamoylphenyl)-5-methyl-1,2-oxazole-3-carboxamide (CID 61128987) is N-(2-chloro-5-sulfamoylphenyl)-5-methyl-1,2-oxazole-3-carboxamide.
What is the SMILES notation for N-(2-chloro-5-sulfamoylphenyl)-5-methyl-1,2-oxazole-3-carboxamide?
The canonical SMILES for N-(2-chloro-5-sulfamoylphenyl)-5-methyl-1,2-oxazole-3-carboxamide is Cc1cc(C(=O)Nc2cc(S(N)(=O)=O)ccc2Cl)no1.
What is the InChIKey of N-(2-chloro-5-sulfamoylphenyl)-5-methyl-1,2-oxazole-3-carboxamide?
The InChIKey is FLIXMCXPTQXVGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10ClN3O4S/c1-6-4-10(15-19-6)11(16)14-9-5-7(20(13,17)18)2-3-8(9)12/h2-5H,1H3,(H,14,16)(H2,13,17,18).
What are the key properties of N-(2-chloro-5-sulfamoylphenyl)-5-methyl-1,2-oxazole-3-carboxamide?
N-(2-chloro-5-sulfamoylphenyl)-5-methyl-1,2-oxazole-3-carboxamide has a molecular weight of 315.74 g/mol, XLogP of 1.54, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chloro-5-sulfamoylphenyl)-5-methyl-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 61128987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).