2-methoxy-N-(5-methyl-1,2-oxazol-3-yl)-5-morpholin-4-ylsulfonylbenzamide

C16H19N3O6S — CID 1258146

IUPAC2-methoxy-N-(5-methyl-1,2-oxazol-3-yl)-5-morpholin-4-ylsulfonylbenzamide
SMILESCOc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)Nc1cc(C)on1
InChIInChI=1S/C16H19N3O6S/c1-11-9-15(18-25-11)17-16(20)13-10-12(3-4-14(13)23-2)26(21,22)19-5-7-24-8-6-19/h3-4,9-10H,5-8H2,1-2H3,(H,17,18,20)
InChIKeyZQYKIZYZPQOABY-UHFFFAOYSA-N
MW381.41 g/mol
LogP1.26
Rot. Bonds5

About 2-methoxy-N-(5-methyl-1,2-oxazol-3-yl)-5-morpholin-4-ylsulfonylbenzamide

2-methoxy-N-(5-methyl-1,2-oxazol-3-yl)-5-morpholin-4-ylsulfonylbenzamide (PubChem CID 1258146) has the molecular formula C16H19N3O6S and a molecular weight of 381.41 g/mol. Its IUPAC name is 2-methoxy-N-(5-methyl-1,2-oxazol-3-yl)-5-morpholin-4-ylsulfonylbenzamide.

Molecular Properties

Compound Name2-methoxy-N-(5-methyl-1,2-oxazol-3-yl)-5-morpholin-4-ylsulfonylbenzamide
PubChem CID1258146
Molecular FormulaC16H19N3O6S
Molecular Weight381.41 g/mol
Exact Mass381.10
IUPAC Name2-methoxy-N-(5-methyl-1,2-oxazol-3-yl)-5-morpholin-4-ylsulfonylbenzamide
SMILESCOc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)Nc1cc(C)on1
InChIInChI=1S/C16H19N3O6S/c1-11-9-15(18-25-11)17-16(20)13-10-12(3-4-14(13)23-2)26(21,22)19-5-7-24-8-6-19/h3-4,9-10H,5-8H2,1-2H3,(H,17,18,20)
InChIKeyZQYKIZYZPQOABY-UHFFFAOYSA-N
XLogP1.26
TPSA110.97 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.41
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

2-methoxy-N-(4-{[(5-methyl-3-isoxazolyl)amino]sulfonyl}phenyl)benzamide
CID 1093076
N-(5-tert-butylisoxazol-3-yl)-3-(morpholin-4-ylsulfonyl)benzamide
CID 1217143
2-[(5-Methyl-3-isoxazolyl)amino]-2-oxoethyl 3-[[(4-methoxyphenyl)amino]sulfonyl]benzoate
CID 2098151
[2-[(5-Methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl] 3-[(2-methoxyphenyl)sulfamoyl]benzoate
CID 2116681
N-(5-methyl-1,2-oxazol-3-yl)-4-morpholin-4-ylsulfonylbenzamide
CID 2379774
N-(5-methyl-1,2-oxazol-3-yl)-4-[(4-oxochromen-3-yl)methylamino]benzenesulfonamide
CID 118733949
5-[(2-methoxyphenyl)sulfamoyl]-2-methyl-N-(5-methyl-1,2-oxazol-3-yl)benzamide
CID 2344220
2-[2-[(5-Methyl-1,2-oxazol-3-yl)amino]-2-oxoethoxy]benzamide
CID 2530119
N-3-isoxazolyl-2-methoxy-5-(4-morpholinylsulfonyl)benzamide
CID 1289870
4-[(2-Methoxyphenyl)-methylsulfamoyl]benzoic acid [2-[(5-methyl-3-isoxazolyl)amino]-2-oxoethyl] ester
CID 2115687
2-methoxy-N-(5-methyl-1,2-oxazol-3-yl)-5-(piperidin-1-ylsulfonyl)benzamide
CID 7223587
N-(5-Methyl-isoxazol-3-yl)-3-(morpholine-4-sulfonyl)-benzamide
CID 1117963

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-(5-methyl-1,2-oxazol-3-yl)-5-morpholin-4-ylsulfonylbenzamide?
The IUPAC name of 2-methoxy-N-(5-methyl-1,2-oxazol-3-yl)-5-morpholin-4-ylsulfonylbenzamide (CID 1258146) is 2-methoxy-N-(5-methyl-1,2-oxazol-3-yl)-5-morpholin-4-ylsulfonylbenzamide.
What is the SMILES notation for 2-methoxy-N-(5-methyl-1,2-oxazol-3-yl)-5-morpholin-4-ylsulfonylbenzamide?
The canonical SMILES for 2-methoxy-N-(5-methyl-1,2-oxazol-3-yl)-5-morpholin-4-ylsulfonylbenzamide is COc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)Nc1cc(C)on1.
What is the InChIKey of 2-methoxy-N-(5-methyl-1,2-oxazol-3-yl)-5-morpholin-4-ylsulfonylbenzamide?
The InChIKey is ZQYKIZYZPQOABY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O6S/c1-11-9-15(18-25-11)17-16(20)13-10-12(3-4-14(13)23-2)26(21,22)19-5-7-24-8-6-19/h3-4,9-10H,5-8H2,1-2H3,(H,17,18,20).
What are the key properties of 2-methoxy-N-(5-methyl-1,2-oxazol-3-yl)-5-morpholin-4-ylsulfonylbenzamide?
2-methoxy-N-(5-methyl-1,2-oxazol-3-yl)-5-morpholin-4-ylsulfonylbenzamide has a molecular weight of 381.41 g/mol, XLogP of 1.26, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-(5-methyl-1,2-oxazol-3-yl)-5-morpholin-4-ylsulfonylbenzamide is sourced from PubChem (CID 1258146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).