2-(2,5-dimethylanilino)-N-(dimethylsulfamoyl)-1,3-oxazole-4-carboxamide

C14H18N4O4S — CID 156549519

IUPAC2-(2,5-dimethylanilino)-N-(dimethylsulfamoyl)-1,3-oxazole-4-carboxamide
SMILESCc1ccc(C)c(Nc2nc(C(=O)NS(=O)(=O)N(C)C)co2)c1
InChIInChI=1S/C14H18N4O4S/c1-9-5-6-10(2)11(7-9)15-14-16-12(8-22-14)13(19)17-23(20,21)18(3)4/h5-8H,1-4H3,(H,15,16)(H,17,19)
InChIKeyNTEZCNIXDVFCNP-UHFFFAOYSA-N
MW338.39 g/mol
LogP1.57
Rot. Bonds5

About 2-(2,5-dimethylanilino)-N-(dimethylsulfamoyl)-1,3-oxazole-4-carboxamide

2-(2,5-dimethylanilino)-N-(dimethylsulfamoyl)-1,3-oxazole-4-carboxamide (PubChem CID 156549519) has the molecular formula C14H18N4O4S and a molecular weight of 338.39 g/mol. Its IUPAC name is 2-(2,5-dimethylanilino)-N-(dimethylsulfamoyl)-1,3-oxazole-4-carboxamide.

Molecular Properties

Compound Name2-(2,5-dimethylanilino)-N-(dimethylsulfamoyl)-1,3-oxazole-4-carboxamide
PubChem CID156549519
Molecular FormulaC14H18N4O4S
Molecular Weight338.39 g/mol
Exact Mass338.10
IUPAC Name2-(2,5-dimethylanilino)-N-(dimethylsulfamoyl)-1,3-oxazole-4-carboxamide
SMILESCc1ccc(C)c(Nc2nc(C(=O)NS(=O)(=O)N(C)C)co2)c1
InChIInChI=1S/C14H18N4O4S/c1-9-5-6-10(2)11(7-9)15-14-16-12(8-22-14)13(19)17-23(20,21)18(3)4/h5-8H,1-4H3,(H,15,16)(H,17,19)
InChIKeyNTEZCNIXDVFCNP-UHFFFAOYSA-N
XLogP1.57
TPSA104.54 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.39
LogP ≤ 51.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dimethylanilino)-N-(dimethylsulfamoyl)-1,3-oxazole-4-carboxamide?
The IUPAC name of 2-(2,5-dimethylanilino)-N-(dimethylsulfamoyl)-1,3-oxazole-4-carboxamide (CID 156549519) is 2-(2,5-dimethylanilino)-N-(dimethylsulfamoyl)-1,3-oxazole-4-carboxamide.
What is the SMILES notation for 2-(2,5-dimethylanilino)-N-(dimethylsulfamoyl)-1,3-oxazole-4-carboxamide?
The canonical SMILES for 2-(2,5-dimethylanilino)-N-(dimethylsulfamoyl)-1,3-oxazole-4-carboxamide is Cc1ccc(C)c(Nc2nc(C(=O)NS(=O)(=O)N(C)C)co2)c1.
What is the InChIKey of 2-(2,5-dimethylanilino)-N-(dimethylsulfamoyl)-1,3-oxazole-4-carboxamide?
The InChIKey is NTEZCNIXDVFCNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O4S/c1-9-5-6-10(2)11(7-9)15-14-16-12(8-22-14)13(19)17-23(20,21)18(3)4/h5-8H,1-4H3,(H,15,16)(H,17,19).
What are the key properties of 2-(2,5-dimethylanilino)-N-(dimethylsulfamoyl)-1,3-oxazole-4-carboxamide?
2-(2,5-dimethylanilino)-N-(dimethylsulfamoyl)-1,3-oxazole-4-carboxamide has a molecular weight of 338.39 g/mol, XLogP of 1.57, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dimethylanilino)-N-(dimethylsulfamoyl)-1,3-oxazole-4-carboxamide is sourced from PubChem (CID 156549519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).