N-(2-acetylphenyl)-4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzamide

C21H20N2O4 — CID 2466270

IUPACN-(2-acetylphenyl)-4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzamide
SMILESCC(=O)c1ccccc1NC(=O)c1ccc(OCc2c(C)noc2C)cc1
InChIInChI=1S/C21H20N2O4/c1-13-19(15(3)27-23-13)12-26-17-10-8-16(9-11-17)21(25)22-20-7-5-4-6-18(20)14(2)24/h4-11H,12H2,1-3H3,(H,22,25)
InChIKeyCMBUVFVSMSPMNT-UHFFFAOYSA-N
MW364.40 g/mol
LogP4.33
Rot. Bonds6

About N-(2-acetylphenyl)-4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzamide

N-(2-acetylphenyl)-4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzamide (PubChem CID 2466270) has the molecular formula C21H20N2O4 and a molecular weight of 364.40 g/mol. Its IUPAC name is N-(2-acetylphenyl)-4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzamide.

Molecular Properties

Compound NameN-(2-acetylphenyl)-4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzamide
PubChem CID2466270
Molecular FormulaC21H20N2O4
Molecular Weight364.40 g/mol
Exact Mass364.14
IUPAC NameN-(2-acetylphenyl)-4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzamide
SMILESCC(=O)c1ccccc1NC(=O)c1ccc(OCc2c(C)noc2C)cc1
InChIInChI=1S/C21H20N2O4/c1-13-19(15(3)27-23-13)12-26-17-10-8-16(9-11-17)21(25)22-20-7-5-4-6-18(20)14(2)24/h4-11H,12H2,1-3H3,(H,22,25)
InChIKeyCMBUVFVSMSPMNT-UHFFFAOYSA-N
XLogP4.33
TPSA81.43 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.40
LogP ≤ 54.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(2-acetylphenyl)-4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(2-acetylphenyl)-4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzamide?
The IUPAC name of N-(2-acetylphenyl)-4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzamide (CID 2466270) is N-(2-acetylphenyl)-4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzamide.
What is the SMILES notation for N-(2-acetylphenyl)-4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzamide?
The canonical SMILES for N-(2-acetylphenyl)-4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzamide is CC(=O)c1ccccc1NC(=O)c1ccc(OCc2c(C)noc2C)cc1.
What is the InChIKey of N-(2-acetylphenyl)-4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzamide?
The InChIKey is CMBUVFVSMSPMNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N2O4/c1-13-19(15(3)27-23-13)12-26-17-10-8-16(9-11-17)21(25)22-20-7-5-4-6-18(20)14(2)24/h4-11H,12H2,1-3H3,(H,22,25).
What are the key properties of N-(2-acetylphenyl)-4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzamide?
N-(2-acetylphenyl)-4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzamide has a molecular weight of 364.40 g/mol, XLogP of 4.33, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-acetylphenyl)-4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzamide is sourced from PubChem (CID 2466270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).