4-(diethylsulfamoyl)-N-(5-methyl-1,2-oxazol-3-yl)benzamide

C15H19N3O4S — CID 4963102

IUPAC4-(diethylsulfamoyl)-N-(5-methyl-1,2-oxazol-3-yl)benzamide
SMILESCCN(CC)S(=O)(=O)c1ccc(C(=O)Nc2cc(C)on2)cc1
InChIInChI=1S/C15H19N3O4S/c1-4-18(5-2)23(20,21)13-8-6-12(7-9-13)15(19)16-14-10-11(3)22-17-14/h6-10H,4-5H2,1-3H3,(H,16,17,19)
InChIKeyBTEGAPPJQHLFGJ-UHFFFAOYSA-N
MW337.40 g/mol
LogP2.27
Rot. Bonds6

About 4-(diethylsulfamoyl)-N-(5-methyl-1,2-oxazol-3-yl)benzamide

4-(diethylsulfamoyl)-N-(5-methyl-1,2-oxazol-3-yl)benzamide (PubChem CID 4963102) has the molecular formula C15H19N3O4S and a molecular weight of 337.40 g/mol. Its IUPAC name is 4-(diethylsulfamoyl)-N-(5-methyl-1,2-oxazol-3-yl)benzamide.

Molecular Properties

Compound Name4-(diethylsulfamoyl)-N-(5-methyl-1,2-oxazol-3-yl)benzamide
PubChem CID4963102
Molecular FormulaC15H19N3O4S
Molecular Weight337.40 g/mol
Exact Mass337.11
IUPAC Name4-(diethylsulfamoyl)-N-(5-methyl-1,2-oxazol-3-yl)benzamide
SMILESCCN(CC)S(=O)(=O)c1ccc(C(=O)Nc2cc(C)on2)cc1
InChIInChI=1S/C15H19N3O4S/c1-4-18(5-2)23(20,21)13-8-6-12(7-9-13)15(19)16-14-10-11(3)22-17-14/h6-10H,4-5H2,1-3H3,(H,16,17,19)
InChIKeyBTEGAPPJQHLFGJ-UHFFFAOYSA-N
XLogP2.27
TPSA92.51 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.40
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-methyl-N-(5-methyl-1,2-oxazol-3-yl)-5-piperidin-1-ylsulfonylbenzamide
CID 2344800
N-(5-methyl-3-isoxazolyl)-4-[methyl(phenylsulfonyl)amino]benzamide
CID 1310191
N-(5-tert-butyl-1,2-oxazol-3-yl)-2-methyl-2-[4-(trifluoromethyl)phenyl]sulfonylpropanamide
CID 22474540
N-(4-{[(5-methyl-3-isoxazolyl)amino]sulfonyl}phenyl)cyclohexanecarboxamide
CID 1181036
Benzamide, N-(5-methyl-3-isoxazolyl)-
CID 569560
N-(5-methyl-3-isoxazolyl)-4-{[(4-methylphenyl)sulfonyl]amino}benzamide
CID 1300581
2-methyl-N-(5-methyl-1,2-oxazol-3-yl)benzamide
CID 840302
5-(Tert-butyl)-3-[({[(4-methylphenyl)sulfonyl]amino}carbonyl)amino]isoxazole
CID 2813928
N-(5-methylisoxazol-3-yl)-2-tosylacetamide
CID 2969761
N-(5-Methyl-isoxazol-3-yl)-3-p-tolylsulfamoyl-benzamide
CID 1253133
N-(5-methyl-1,2-oxazol-3-yl)-3-[(2-oxo-4-phenylpyrrolidin-1-yl)sulfonyl]benzamide
CID 4431371
4-[benzyl(propan-2-yl)sulfamoyl]-N-(5-methyl-1,2-oxazol-3-yl)benzamide
CID 7189756

Frequently Asked Questions

What is the IUPAC name of 4-(diethylsulfamoyl)-N-(5-methyl-1,2-oxazol-3-yl)benzamide?
The IUPAC name of 4-(diethylsulfamoyl)-N-(5-methyl-1,2-oxazol-3-yl)benzamide (CID 4963102) is 4-(diethylsulfamoyl)-N-(5-methyl-1,2-oxazol-3-yl)benzamide.
What is the SMILES notation for 4-(diethylsulfamoyl)-N-(5-methyl-1,2-oxazol-3-yl)benzamide?
The canonical SMILES for 4-(diethylsulfamoyl)-N-(5-methyl-1,2-oxazol-3-yl)benzamide is CCN(CC)S(=O)(=O)c1ccc(C(=O)Nc2cc(C)on2)cc1.
What is the InChIKey of 4-(diethylsulfamoyl)-N-(5-methyl-1,2-oxazol-3-yl)benzamide?
The InChIKey is BTEGAPPJQHLFGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O4S/c1-4-18(5-2)23(20,21)13-8-6-12(7-9-13)15(19)16-14-10-11(3)22-17-14/h6-10H,4-5H2,1-3H3,(H,16,17,19).
What are the key properties of 4-(diethylsulfamoyl)-N-(5-methyl-1,2-oxazol-3-yl)benzamide?
4-(diethylsulfamoyl)-N-(5-methyl-1,2-oxazol-3-yl)benzamide has a molecular weight of 337.40 g/mol, XLogP of 2.27, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(diethylsulfamoyl)-N-(5-methyl-1,2-oxazol-3-yl)benzamide is sourced from PubChem (CID 4963102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).