2-[(2,5-dimethylphenyl)sulfonylamino]-N-(5-methyl-1,2-oxazol-3-yl)benzamide

C19H19N3O4S — CID 2354951

IUPAC2-[(2,5-dimethylphenyl)sulfonylamino]-N-(5-methyl-1,2-oxazol-3-yl)benzamide
SMILESCc1ccc(C)c(S(=O)(=O)Nc2ccccc2C(=O)Nc2cc(C)on2)c1
InChIInChI=1S/C19H19N3O4S/c1-12-8-9-13(2)17(10-12)27(24,25)22-16-7-5-4-6-15(16)19(23)20-18-11-14(3)26-21-18/h4-11,22H,1-3H3,(H,20,21,23)
InChIKeyQNDORFKPQJBTBU-UHFFFAOYSA-N
MW385.45 g/mol
LogP3.65
Rot. Bonds5

About 2-[(2,5-dimethylphenyl)sulfonylamino]-N-(5-methyl-1,2-oxazol-3-yl)benzamide

2-[(2,5-dimethylphenyl)sulfonylamino]-N-(5-methyl-1,2-oxazol-3-yl)benzamide (PubChem CID 2354951) has the molecular formula C19H19N3O4S and a molecular weight of 385.45 g/mol. Its IUPAC name is 2-[(2,5-dimethylphenyl)sulfonylamino]-N-(5-methyl-1,2-oxazol-3-yl)benzamide.

Molecular Properties

Compound Name2-[(2,5-dimethylphenyl)sulfonylamino]-N-(5-methyl-1,2-oxazol-3-yl)benzamide
PubChem CID2354951
Molecular FormulaC19H19N3O4S
Molecular Weight385.45 g/mol
Exact Mass385.11
IUPAC Name2-[(2,5-dimethylphenyl)sulfonylamino]-N-(5-methyl-1,2-oxazol-3-yl)benzamide
SMILESCc1ccc(C)c(S(=O)(=O)Nc2ccccc2C(=O)Nc2cc(C)on2)c1
InChIInChI=1S/C19H19N3O4S/c1-12-8-9-13(2)17(10-12)27(24,25)22-16-7-5-4-6-15(16)19(23)20-18-11-14(3)26-21-18/h4-11,22H,1-3H3,(H,20,21,23)
InChIKeyQNDORFKPQJBTBU-UHFFFAOYSA-N
XLogP3.65
TPSA101.30 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.45
LogP ≤ 53.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[(2,5-dimethylphenyl)sulfonylamino]-N-(5-methyl-1,2-oxazol-3-yl)benzamide?
The IUPAC name of 2-[(2,5-dimethylphenyl)sulfonylamino]-N-(5-methyl-1,2-oxazol-3-yl)benzamide (CID 2354951) is 2-[(2,5-dimethylphenyl)sulfonylamino]-N-(5-methyl-1,2-oxazol-3-yl)benzamide.
What is the SMILES notation for 2-[(2,5-dimethylphenyl)sulfonylamino]-N-(5-methyl-1,2-oxazol-3-yl)benzamide?
The canonical SMILES for 2-[(2,5-dimethylphenyl)sulfonylamino]-N-(5-methyl-1,2-oxazol-3-yl)benzamide is Cc1ccc(C)c(S(=O)(=O)Nc2ccccc2C(=O)Nc2cc(C)on2)c1.
What is the InChIKey of 2-[(2,5-dimethylphenyl)sulfonylamino]-N-(5-methyl-1,2-oxazol-3-yl)benzamide?
The InChIKey is QNDORFKPQJBTBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O4S/c1-12-8-9-13(2)17(10-12)27(24,25)22-16-7-5-4-6-15(16)19(23)20-18-11-14(3)26-21-18/h4-11,22H,1-3H3,(H,20,21,23).
What are the key properties of 2-[(2,5-dimethylphenyl)sulfonylamino]-N-(5-methyl-1,2-oxazol-3-yl)benzamide?
2-[(2,5-dimethylphenyl)sulfonylamino]-N-(5-methyl-1,2-oxazol-3-yl)benzamide has a molecular weight of 385.45 g/mol, XLogP of 3.65, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2,5-dimethylphenyl)sulfonylamino]-N-(5-methyl-1,2-oxazol-3-yl)benzamide is sourced from PubChem (CID 2354951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).