4-[2-(5-acetyl-2-methylanilino)-1,3-oxazol-5-yl]benzamide

C19H17N3O3 — CID 11965524

IUPAC4-[2-(5-acetyl-2-methylanilino)-1,3-oxazol-5-yl]benzamide
SMILESCC(=O)c1ccc(C)c(Nc2ncc(-c3ccc(C(N)=O)cc3)o2)c1
InChIInChI=1S/C19H17N3O3/c1-11-3-4-15(12(2)23)9-16(11)22-19-21-10-17(25-19)13-5-7-14(8-6-13)18(20)24/h3-10H,1-2H3,(H2,20,24)(H,21,22)
InChIKeyAZAYRZCHFFAKMB-UHFFFAOYSA-N
MW335.36 g/mol
LogP3.70
Rot. Bonds5

About 4-[2-(5-acetyl-2-methylanilino)-1,3-oxazol-5-yl]benzamide

4-[2-(5-acetyl-2-methylanilino)-1,3-oxazol-5-yl]benzamide (PubChem CID 11965524) has the molecular formula C19H17N3O3 and a molecular weight of 335.36 g/mol. Its IUPAC name is 4-[2-(5-acetyl-2-methylanilino)-1,3-oxazol-5-yl]benzamide.

Molecular Properties

Compound Name4-[2-(5-acetyl-2-methylanilino)-1,3-oxazol-5-yl]benzamide
PubChem CID11965524
Molecular FormulaC19H17N3O3
Molecular Weight335.36 g/mol
Exact Mass335.13
IUPAC Name4-[2-(5-acetyl-2-methylanilino)-1,3-oxazol-5-yl]benzamide
SMILESCC(=O)c1ccc(C)c(Nc2ncc(-c3ccc(C(N)=O)cc3)o2)c1
InChIInChI=1S/C19H17N3O3/c1-11-3-4-15(12(2)23)9-16(11)22-19-21-10-17(25-19)13-5-7-14(8-6-13)18(20)24/h3-10H,1-2H3,(H2,20,24)(H,21,22)
InChIKeyAZAYRZCHFFAKMB-UHFFFAOYSA-N
XLogP3.70
TPSA98.22 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.36
LogP ≤ 53.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-[2-(5-acetyl-2-methylanilino)-1,3-oxazol-5-yl]benzamide?
The IUPAC name of 4-[2-(5-acetyl-2-methylanilino)-1,3-oxazol-5-yl]benzamide (CID 11965524) is 4-[2-(5-acetyl-2-methylanilino)-1,3-oxazol-5-yl]benzamide.
What is the SMILES notation for 4-[2-(5-acetyl-2-methylanilino)-1,3-oxazol-5-yl]benzamide?
The canonical SMILES for 4-[2-(5-acetyl-2-methylanilino)-1,3-oxazol-5-yl]benzamide is CC(=O)c1ccc(C)c(Nc2ncc(-c3ccc(C(N)=O)cc3)o2)c1.
What is the InChIKey of 4-[2-(5-acetyl-2-methylanilino)-1,3-oxazol-5-yl]benzamide?
The InChIKey is AZAYRZCHFFAKMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N3O3/c1-11-3-4-15(12(2)23)9-16(11)22-19-21-10-17(25-19)13-5-7-14(8-6-13)18(20)24/h3-10H,1-2H3,(H2,20,24)(H,21,22).
What are the key properties of 4-[2-(5-acetyl-2-methylanilino)-1,3-oxazol-5-yl]benzamide?
4-[2-(5-acetyl-2-methylanilino)-1,3-oxazol-5-yl]benzamide has a molecular weight of 335.36 g/mol, XLogP of 3.70, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(5-acetyl-2-methylanilino)-1,3-oxazol-5-yl]benzamide is sourced from PubChem (CID 11965524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).