2-(5-methyl-1,2-benzoxazol-3-yl)-N-(2-methylphenyl)acetamide

C17H16N2O2 — CID 22519860

IUPAC2-(5-methyl-1,2-benzoxazol-3-yl)-N-(2-methylphenyl)acetamide
SMILESCc1ccc2onc(CC(=O)Nc3ccccc3C)c2c1
InChIInChI=1S/C17H16N2O2/c1-11-7-8-16-13(9-11)15(19-21-16)10-17(20)18-14-6-4-3-5-12(14)2/h3-9H,10H2,1-2H3,(H,18,20)
InChIKeyLGJSOWKETSIBSM-UHFFFAOYSA-N
MW280.33 g/mol
LogP3.63
Rot. Bonds3

About 2-(5-methyl-1,2-benzoxazol-3-yl)-N-(2-methylphenyl)acetamide

2-(5-methyl-1,2-benzoxazol-3-yl)-N-(2-methylphenyl)acetamide (PubChem CID 22519860) has the molecular formula C17H16N2O2 and a molecular weight of 280.33 g/mol. Its IUPAC name is 2-(5-methyl-1,2-benzoxazol-3-yl)-N-(2-methylphenyl)acetamide.

Molecular Properties

Compound Name2-(5-methyl-1,2-benzoxazol-3-yl)-N-(2-methylphenyl)acetamide
PubChem CID22519860
Molecular FormulaC17H16N2O2
Molecular Weight280.33 g/mol
Exact Mass280.12
IUPAC Name2-(5-methyl-1,2-benzoxazol-3-yl)-N-(2-methylphenyl)acetamide
SMILESCc1ccc2onc(CC(=O)Nc3ccccc3C)c2c1
InChIInChI=1S/C17H16N2O2/c1-11-7-8-16-13(9-11)15(19-21-16)10-17(20)18-14-6-4-3-5-12(14)2/h3-9H,10H2,1-2H3,(H,18,20)
InChIKeyLGJSOWKETSIBSM-UHFFFAOYSA-N
XLogP3.63
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.33
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[2-(5-methyl-1,2-benzoxazol-3-yl)acetyl]amino]benzoic acid
CID 108803274
2-(5-methyl-1,2-benzoxazol-3-yl)-N-pyridin-2-ylacetamide
CID 22519774
N-(2-methoxy-5-methylphenyl)-2-(5-methyl-1,2-benzoxazol-3-yl)acetamide
CID 22519804
2-(5-methyl-1,2-benzoxazol-3-yl)-N-(2,3,4-trifluorophenyl)acetamide
CID 108803187
N-(4-bromo-2-fluorophenyl)-2-(5-methyl-1,2-benzoxazol-3-yl)acetamide
CID 108803279
N-ethyl-2-(5-methyl-1,2-benzoxazol-3-yl)acetamide
CID 108790457
N-(3-fluoro-4-methylphenyl)-2-(5-methyl-1,2-benzoxazol-3-yl)acetamide
CID 22519775
N-(4-methyl-1,3-benzothiazol-2-yl)-2-(5-methyl-1,2-benzoxazol-3-yl)acetamide
CID 108790507
2-(5-methyl-1,2-benzoxazol-3-yl)-N-[(1S)-1-phenylethyl]acetamide
CID 40647250
2-(5-methyl-1,2-benzoxazol-3-yl)-N-(5-methyl-2-phenylpyrazol-3-yl)acetamide
CID 108803231
1-(2-ethylphenyl)-3-[(5-methyl-1,2-benzoxazol-3-yl)methyl]urea
CID 20901555
2-(5-methyl-1,2-benzoxazol-3-yl)-N-(5-propyl-1,3,4-thiadiazol-2-yl)acetamide
CID 108803255

Frequently Asked Questions

What is the IUPAC name of 2-(5-methyl-1,2-benzoxazol-3-yl)-N-(2-methylphenyl)acetamide?
The IUPAC name of 2-(5-methyl-1,2-benzoxazol-3-yl)-N-(2-methylphenyl)acetamide (CID 22519860) is 2-(5-methyl-1,2-benzoxazol-3-yl)-N-(2-methylphenyl)acetamide.
What is the SMILES notation for 2-(5-methyl-1,2-benzoxazol-3-yl)-N-(2-methylphenyl)acetamide?
The canonical SMILES for 2-(5-methyl-1,2-benzoxazol-3-yl)-N-(2-methylphenyl)acetamide is Cc1ccc2onc(CC(=O)Nc3ccccc3C)c2c1.
What is the InChIKey of 2-(5-methyl-1,2-benzoxazol-3-yl)-N-(2-methylphenyl)acetamide?
The InChIKey is LGJSOWKETSIBSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O2/c1-11-7-8-16-13(9-11)15(19-21-16)10-17(20)18-14-6-4-3-5-12(14)2/h3-9H,10H2,1-2H3,(H,18,20).
What are the key properties of 2-(5-methyl-1,2-benzoxazol-3-yl)-N-(2-methylphenyl)acetamide?
2-(5-methyl-1,2-benzoxazol-3-yl)-N-(2-methylphenyl)acetamide has a molecular weight of 280.33 g/mol, XLogP of 3.63, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-methyl-1,2-benzoxazol-3-yl)-N-(2-methylphenyl)acetamide is sourced from PubChem (CID 22519860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).