N-(dimethylsulfamoyl)-2-(2-methyl-5-propan-2-ylanilino)-1,3-oxazole-4-carboxamide

C16H22N4O4S — CID 156549535

IUPACN-(dimethylsulfamoyl)-2-(2-methyl-5-propan-2-ylanilino)-1,3-oxazole-4-carboxamide
SMILESCc1ccc(C(C)C)cc1Nc1nc(C(=O)NS(=O)(=O)N(C)C)co1
InChIInChI=1S/C16H22N4O4S/c1-10(2)12-7-6-11(3)13(8-12)17-16-18-14(9-24-16)15(21)19-25(22,23)20(4)5/h6-10H,1-5H3,(H,17,18)(H,19,21)
InChIKeyOWPIWJJCPPHECO-UHFFFAOYSA-N
MW366.44 g/mol
LogP2.39
Rot. Bonds6

About N-(dimethylsulfamoyl)-2-(2-methyl-5-propan-2-ylanilino)-1,3-oxazole-4-carboxamide

N-(dimethylsulfamoyl)-2-(2-methyl-5-propan-2-ylanilino)-1,3-oxazole-4-carboxamide (PubChem CID 156549535) has the molecular formula C16H22N4O4S and a molecular weight of 366.44 g/mol. Its IUPAC name is N-(dimethylsulfamoyl)-2-(2-methyl-5-propan-2-ylanilino)-1,3-oxazole-4-carboxamide.

Molecular Properties

Compound NameN-(dimethylsulfamoyl)-2-(2-methyl-5-propan-2-ylanilino)-1,3-oxazole-4-carboxamide
PubChem CID156549535
Molecular FormulaC16H22N4O4S
Molecular Weight366.44 g/mol
Exact Mass366.14
IUPAC NameN-(dimethylsulfamoyl)-2-(2-methyl-5-propan-2-ylanilino)-1,3-oxazole-4-carboxamide
SMILESCc1ccc(C(C)C)cc1Nc1nc(C(=O)NS(=O)(=O)N(C)C)co1
InChIInChI=1S/C16H22N4O4S/c1-10(2)12-7-6-11(3)13(8-12)17-16-18-14(9-24-16)15(21)19-25(22,23)20(4)5/h6-10H,1-5H3,(H,17,18)(H,19,21)
InChIKeyOWPIWJJCPPHECO-UHFFFAOYSA-N
XLogP2.39
TPSA104.54 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.44
LogP ≤ 52.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(dimethylsulfamoyl)-2-(2-methyl-5-propan-2-ylanilino)-1,3-oxazole-4-carboxamide?
The IUPAC name of N-(dimethylsulfamoyl)-2-(2-methyl-5-propan-2-ylanilino)-1,3-oxazole-4-carboxamide (CID 156549535) is N-(dimethylsulfamoyl)-2-(2-methyl-5-propan-2-ylanilino)-1,3-oxazole-4-carboxamide.
What is the SMILES notation for N-(dimethylsulfamoyl)-2-(2-methyl-5-propan-2-ylanilino)-1,3-oxazole-4-carboxamide?
The canonical SMILES for N-(dimethylsulfamoyl)-2-(2-methyl-5-propan-2-ylanilino)-1,3-oxazole-4-carboxamide is Cc1ccc(C(C)C)cc1Nc1nc(C(=O)NS(=O)(=O)N(C)C)co1.
What is the InChIKey of N-(dimethylsulfamoyl)-2-(2-methyl-5-propan-2-ylanilino)-1,3-oxazole-4-carboxamide?
The InChIKey is OWPIWJJCPPHECO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N4O4S/c1-10(2)12-7-6-11(3)13(8-12)17-16-18-14(9-24-16)15(21)19-25(22,23)20(4)5/h6-10H,1-5H3,(H,17,18)(H,19,21).
What are the key properties of N-(dimethylsulfamoyl)-2-(2-methyl-5-propan-2-ylanilino)-1,3-oxazole-4-carboxamide?
N-(dimethylsulfamoyl)-2-(2-methyl-5-propan-2-ylanilino)-1,3-oxazole-4-carboxamide has a molecular weight of 366.44 g/mol, XLogP of 2.39, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(dimethylsulfamoyl)-2-(2-methyl-5-propan-2-ylanilino)-1,3-oxazole-4-carboxamide is sourced from PubChem (CID 156549535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).