N-(4-acetamidophenyl)-5-methyl-2-phenyl-1,3-oxazole-4-carboxamide

C19H17N3O3 — CID 2457157

IUPACN-(4-acetamidophenyl)-5-methyl-2-phenyl-1,3-oxazole-4-carboxamide
SMILESCC(=O)Nc1ccc(NC(=O)c2nc(-c3ccccc3)oc2C)cc1
InChIInChI=1S/C19H17N3O3/c1-12-17(22-19(25-12)14-6-4-3-5-7-14)18(24)21-16-10-8-15(9-11-16)20-13(2)23/h3-11H,1-2H3,(H,20,23)(H,21,24)
InChIKeyZIXIHEVTHKOSGY-UHFFFAOYSA-N
MW335.36 g/mol
LogP3.86
Rot. Bonds4

About N-(4-acetamidophenyl)-5-methyl-2-phenyl-1,3-oxazole-4-carboxamide

N-(4-acetamidophenyl)-5-methyl-2-phenyl-1,3-oxazole-4-carboxamide (PubChem CID 2457157) has the molecular formula C19H17N3O3 and a molecular weight of 335.36 g/mol. Its IUPAC name is N-(4-acetamidophenyl)-5-methyl-2-phenyl-1,3-oxazole-4-carboxamide.

Molecular Properties

Compound NameN-(4-acetamidophenyl)-5-methyl-2-phenyl-1,3-oxazole-4-carboxamide
PubChem CID2457157
Molecular FormulaC19H17N3O3
Molecular Weight335.36 g/mol
Exact Mass335.13
IUPAC NameN-(4-acetamidophenyl)-5-methyl-2-phenyl-1,3-oxazole-4-carboxamide
SMILESCC(=O)Nc1ccc(NC(=O)c2nc(-c3ccccc3)oc2C)cc1
InChIInChI=1S/C19H17N3O3/c1-12-17(22-19(25-12)14-6-4-3-5-7-14)18(24)21-16-10-8-15(9-11-16)20-13(2)23/h3-11H,1-2H3,(H,20,23)(H,21,24)
InChIKeyZIXIHEVTHKOSGY-UHFFFAOYSA-N
XLogP3.86
TPSA84.23 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.36
LogP ≤ 53.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(4-acetamidophenyl)-5-methyl-2-phenyl-1,3-oxazole-4-carboxamide?
The IUPAC name of N-(4-acetamidophenyl)-5-methyl-2-phenyl-1,3-oxazole-4-carboxamide (CID 2457157) is N-(4-acetamidophenyl)-5-methyl-2-phenyl-1,3-oxazole-4-carboxamide.
What is the SMILES notation for N-(4-acetamidophenyl)-5-methyl-2-phenyl-1,3-oxazole-4-carboxamide?
The canonical SMILES for N-(4-acetamidophenyl)-5-methyl-2-phenyl-1,3-oxazole-4-carboxamide is CC(=O)Nc1ccc(NC(=O)c2nc(-c3ccccc3)oc2C)cc1.
What is the InChIKey of N-(4-acetamidophenyl)-5-methyl-2-phenyl-1,3-oxazole-4-carboxamide?
The InChIKey is ZIXIHEVTHKOSGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N3O3/c1-12-17(22-19(25-12)14-6-4-3-5-7-14)18(24)21-16-10-8-15(9-11-16)20-13(2)23/h3-11H,1-2H3,(H,20,23)(H,21,24).
What are the key properties of N-(4-acetamidophenyl)-5-methyl-2-phenyl-1,3-oxazole-4-carboxamide?
N-(4-acetamidophenyl)-5-methyl-2-phenyl-1,3-oxazole-4-carboxamide has a molecular weight of 335.36 g/mol, XLogP of 3.86, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetamidophenyl)-5-methyl-2-phenyl-1,3-oxazole-4-carboxamide is sourced from PubChem (CID 2457157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).