N-(5-acetamido-2-methoxyphenyl)-5-methyl-1,2-oxazole-3-carboxamide

C14H15N3O4 — CID 17417372

IUPACN-(5-acetamido-2-methoxyphenyl)-5-methyl-1,2-oxazole-3-carboxamide
SMILESCOc1ccc(NC(C)=O)cc1NC(=O)c1cc(C)on1
InChIInChI=1S/C14H15N3O4/c1-8-6-12(17-21-8)14(19)16-11-7-10(15-9(2)18)4-5-13(11)20-3/h4-7H,1-3H3,(H,15,18)(H,16,19)
InChIKeyAZJYVVGVGFCQPT-UHFFFAOYSA-N
MW289.29 g/mol
LogP2.20
Rot. Bonds4

About N-(5-acetamido-2-methoxyphenyl)-5-methyl-1,2-oxazole-3-carboxamide

N-(5-acetamido-2-methoxyphenyl)-5-methyl-1,2-oxazole-3-carboxamide (PubChem CID 17417372) has the molecular formula C14H15N3O4 and a molecular weight of 289.29 g/mol. Its IUPAC name is N-(5-acetamido-2-methoxyphenyl)-5-methyl-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound NameN-(5-acetamido-2-methoxyphenyl)-5-methyl-1,2-oxazole-3-carboxamide
PubChem CID17417372
Molecular FormulaC14H15N3O4
Molecular Weight289.29 g/mol
Exact Mass289.11
IUPAC NameN-(5-acetamido-2-methoxyphenyl)-5-methyl-1,2-oxazole-3-carboxamide
SMILESCOc1ccc(NC(C)=O)cc1NC(=O)c1cc(C)on1
InChIInChI=1S/C14H15N3O4/c1-8-6-12(17-21-8)14(19)16-11-7-10(15-9(2)18)4-5-13(11)20-3/h4-7H,1-3H3,(H,15,18)(H,16,19)
InChIKeyAZJYVVGVGFCQPT-UHFFFAOYSA-N
XLogP2.20
TPSA93.46 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.29
LogP ≤ 52.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3-chloro-4-methoxyphenyl)-5-methyl-1,2-oxazole-3-carboxamide
CID 2470130
N-(5-acetamido-2-methoxyphenyl)-1,3-thiazole-4-carboxamide
CID 62047199
N-(5-acetamido-2-methoxyphenyl)-6-methoxypyrimidine-4-carboxamide
CID 121167268
N-[4-[(Z)-N'-hydroxycarbamimidoyl]-2-methoxyphenyl]-5-methyl-1,2-oxazole-3-carboxamide
CID 104849872
N-(5-acetamido-2-methoxyphenyl)-2-(3,4-dichlorophenyl)-1,3-thiazole-4-carboxamide
CID 60597278
N-(5-acetamido-2-methoxyphenyl)-2-(4-chlorophenyl)-1,3-thiazole-4-carboxamide
CID 42092835
N-(5-acetamido-2-methoxyphenyl)-2,3-dichlorobenzamide
CID 17429613
N-(5-acetamido-2-methoxyphenyl)-2,3-dimethylbenzamide
CID 8873770
N-(5-acetamido-2-methoxyphenyl)-2-(3,4-dimethoxyanilino)-1,3-thiazole-4-carboxamide
CID 16821159
5-methyl-N-(4-methylphenyl)-1,2-oxazole-3-carboxamide
CID 3236095
5-methyl-N-[3-[(5-methyl-1,2-oxazole-3-carbonyl)amino]phenyl]-1,2-oxazole-3-carboxamide
CID 58725196
N-[3-[(2-bromo-5-methylphenyl)sulfamoyl]-4-methoxyphenyl]-5-methyl-1,2-oxazole-3-carboxamide
CID 25472760

Frequently Asked Questions

What is the IUPAC name of N-(5-acetamido-2-methoxyphenyl)-5-methyl-1,2-oxazole-3-carboxamide?
The IUPAC name of N-(5-acetamido-2-methoxyphenyl)-5-methyl-1,2-oxazole-3-carboxamide (CID 17417372) is N-(5-acetamido-2-methoxyphenyl)-5-methyl-1,2-oxazole-3-carboxamide.
What is the SMILES notation for N-(5-acetamido-2-methoxyphenyl)-5-methyl-1,2-oxazole-3-carboxamide?
The canonical SMILES for N-(5-acetamido-2-methoxyphenyl)-5-methyl-1,2-oxazole-3-carboxamide is COc1ccc(NC(C)=O)cc1NC(=O)c1cc(C)on1.
What is the InChIKey of N-(5-acetamido-2-methoxyphenyl)-5-methyl-1,2-oxazole-3-carboxamide?
The InChIKey is AZJYVVGVGFCQPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O4/c1-8-6-12(17-21-8)14(19)16-11-7-10(15-9(2)18)4-5-13(11)20-3/h4-7H,1-3H3,(H,15,18)(H,16,19).
What are the key properties of N-(5-acetamido-2-methoxyphenyl)-5-methyl-1,2-oxazole-3-carboxamide?
N-(5-acetamido-2-methoxyphenyl)-5-methyl-1,2-oxazole-3-carboxamide has a molecular weight of 289.29 g/mol, XLogP of 2.20, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-acetamido-2-methoxyphenyl)-5-methyl-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 17417372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).