4-methyl-N-[4-(4-methylphenyl)-1,2-oxazol-5-yl]benzamide

C18H16N2O2 — CID 110402217

IUPAC4-methyl-N-[4-(4-methylphenyl)-1,2-oxazol-5-yl]benzamide
SMILESCc1ccc(C(=O)Nc2oncc2-c2ccc(C)cc2)cc1
InChIInChI=1S/C18H16N2O2/c1-12-3-7-14(8-4-12)16-11-19-22-18(16)20-17(21)15-9-5-13(2)6-10-15/h3-11H,1-2H3,(H,20,21)
InChIKeyBATHBIZWCNDVLB-UHFFFAOYSA-N
MW292.34 g/mol
LogP4.21
Rot. Bonds3

About 4-methyl-N-[4-(4-methylphenyl)-1,2-oxazol-5-yl]benzamide

4-methyl-N-[4-(4-methylphenyl)-1,2-oxazol-5-yl]benzamide (PubChem CID 110402217) has the molecular formula C18H16N2O2 and a molecular weight of 292.34 g/mol. Its IUPAC name is 4-methyl-N-[4-(4-methylphenyl)-1,2-oxazol-5-yl]benzamide.

Molecular Properties

Compound Name4-methyl-N-[4-(4-methylphenyl)-1,2-oxazol-5-yl]benzamide
PubChem CID110402217
Molecular FormulaC18H16N2O2
Molecular Weight292.34 g/mol
Exact Mass292.12
IUPAC Name4-methyl-N-[4-(4-methylphenyl)-1,2-oxazol-5-yl]benzamide
SMILESCc1ccc(C(=O)Nc2oncc2-c2ccc(C)cc2)cc1
InChIInChI=1S/C18H16N2O2/c1-12-3-7-14(8-4-12)16-11-19-22-18(16)20-17(21)15-9-5-13(2)6-10-15/h3-11H,1-2H3,(H,20,21)
InChIKeyBATHBIZWCNDVLB-UHFFFAOYSA-N
XLogP4.21
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.34
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3,4-dimethoxy-N-[4-(4-methylphenyl)-1,2-oxazol-5-yl]benzamide
CID 110402230
4-methoxy-N-(4-phenyl-1,2-oxazol-5-yl)benzamide
CID 110402060
N-(4-phenyl-1,2-oxazol-5-yl)-4-propan-2-ylbenzamide
CID 110402056
N-[4-(4-methoxyphenyl)-1,2-oxazol-5-yl]-3-methylbenzamide
CID 110402364
N-[4-(4-chlorophenyl)-1,2-oxazol-5-yl]-2-methoxybenzamide
CID 110402522
3-(1,3-dioxoisoindol-2-yl)-N-[4-(4-methylphenyl)-1,2-oxazol-5-yl]propanamide
CID 110402251
1-[4-(4-chlorophenyl)-1,2-oxazol-5-yl]-3-(4-methylphenyl)sulfonylurea
CID 110402562
2,6-dimethoxy-N-(4-phenyl-1,2-oxazol-5-yl)benzamide
CID 110402062
3-[4-(4-chlorophenyl)-1,2-oxazol-5-yl]-1,1-dimethylurea
CID 110402559
1-(4-chlorophenyl)-3-[4-(4-chlorophenyl)-1,2-oxazol-5-yl]urea
CID 110402543
3-methyl-N-(4-phenyl-1,2-oxazol-5-yl)butanamide
CID 110402038
2-(dimethylamino)-N-(4-phenyl-1,2-oxazol-5-yl)acetamide
CID 118895396

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-[4-(4-methylphenyl)-1,2-oxazol-5-yl]benzamide?
The IUPAC name of 4-methyl-N-[4-(4-methylphenyl)-1,2-oxazol-5-yl]benzamide (CID 110402217) is 4-methyl-N-[4-(4-methylphenyl)-1,2-oxazol-5-yl]benzamide.
What is the SMILES notation for 4-methyl-N-[4-(4-methylphenyl)-1,2-oxazol-5-yl]benzamide?
The canonical SMILES for 4-methyl-N-[4-(4-methylphenyl)-1,2-oxazol-5-yl]benzamide is Cc1ccc(C(=O)Nc2oncc2-c2ccc(C)cc2)cc1.
What is the InChIKey of 4-methyl-N-[4-(4-methylphenyl)-1,2-oxazol-5-yl]benzamide?
The InChIKey is BATHBIZWCNDVLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2O2/c1-12-3-7-14(8-4-12)16-11-19-22-18(16)20-17(21)15-9-5-13(2)6-10-15/h3-11H,1-2H3,(H,20,21).
What are the key properties of 4-methyl-N-[4-(4-methylphenyl)-1,2-oxazol-5-yl]benzamide?
4-methyl-N-[4-(4-methylphenyl)-1,2-oxazol-5-yl]benzamide has a molecular weight of 292.34 g/mol, XLogP of 4.21, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-[4-(4-methylphenyl)-1,2-oxazol-5-yl]benzamide is sourced from PubChem (CID 110402217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).