N-(3-acetylphenyl)-5-(4-methylphenyl)-1,2-oxazole-3-carboxamide

C19H16N2O3 — CID 973882

IUPACN-(3-acetylphenyl)-5-(4-methylphenyl)-1,2-oxazole-3-carboxamide
SMILESCC(=O)c1cccc(NC(=O)c2cc(-c3ccc(C)cc3)on2)c1
InChIInChI=1S/C19H16N2O3/c1-12-6-8-14(9-7-12)18-11-17(21-24-18)19(23)20-16-5-3-4-15(10-16)13(2)22/h3-11H,1-2H3,(H,20,23)
InChIKeyUGJWYHQQHCLYME-UHFFFAOYSA-N
MW320.35 g/mol
LogP4.10
Rot. Bonds4

About N-(3-acetylphenyl)-5-(4-methylphenyl)-1,2-oxazole-3-carboxamide

N-(3-acetylphenyl)-5-(4-methylphenyl)-1,2-oxazole-3-carboxamide (PubChem CID 973882) has the molecular formula C19H16N2O3 and a molecular weight of 320.35 g/mol. Its IUPAC name is N-(3-acetylphenyl)-5-(4-methylphenyl)-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound NameN-(3-acetylphenyl)-5-(4-methylphenyl)-1,2-oxazole-3-carboxamide
PubChem CID973882
Molecular FormulaC19H16N2O3
Molecular Weight320.35 g/mol
Exact Mass320.12
IUPAC NameN-(3-acetylphenyl)-5-(4-methylphenyl)-1,2-oxazole-3-carboxamide
SMILESCC(=O)c1cccc(NC(=O)c2cc(-c3ccc(C)cc3)on2)c1
InChIInChI=1S/C19H16N2O3/c1-12-6-8-14(9-7-12)18-11-17(21-24-18)19(23)20-16-5-3-4-15(10-16)13(2)22/h3-11H,1-2H3,(H,20,23)
InChIKeyUGJWYHQQHCLYME-UHFFFAOYSA-N
XLogP4.10
TPSA72.20 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.35
LogP ≤ 54.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(3-acetylphenyl)-5-(4-methylphenyl)-1,2-oxazole-3-carboxamide?
The IUPAC name of N-(3-acetylphenyl)-5-(4-methylphenyl)-1,2-oxazole-3-carboxamide (CID 973882) is N-(3-acetylphenyl)-5-(4-methylphenyl)-1,2-oxazole-3-carboxamide.
What is the SMILES notation for N-(3-acetylphenyl)-5-(4-methylphenyl)-1,2-oxazole-3-carboxamide?
The canonical SMILES for N-(3-acetylphenyl)-5-(4-methylphenyl)-1,2-oxazole-3-carboxamide is CC(=O)c1cccc(NC(=O)c2cc(-c3ccc(C)cc3)on2)c1.
What is the InChIKey of N-(3-acetylphenyl)-5-(4-methylphenyl)-1,2-oxazole-3-carboxamide?
The InChIKey is UGJWYHQQHCLYME-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N2O3/c1-12-6-8-14(9-7-12)18-11-17(21-24-18)19(23)20-16-5-3-4-15(10-16)13(2)22/h3-11H,1-2H3,(H,20,23).
What are the key properties of N-(3-acetylphenyl)-5-(4-methylphenyl)-1,2-oxazole-3-carboxamide?
N-(3-acetylphenyl)-5-(4-methylphenyl)-1,2-oxazole-3-carboxamide has a molecular weight of 320.35 g/mol, XLogP of 4.10, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetylphenyl)-5-(4-methylphenyl)-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 973882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).