2-(5-methyl-1,2-benzoxazol-3-yl)-N-pyridin-2-ylacetamide

C15H13N3O2 — CID 22519774

IUPAC2-(5-methyl-1,2-benzoxazol-3-yl)-N-pyridin-2-ylacetamide
SMILESCc1ccc2onc(CC(=O)Nc3ccccn3)c2c1
InChIInChI=1S/C15H13N3O2/c1-10-5-6-13-11(8-10)12(18-20-13)9-15(19)17-14-4-2-3-7-16-14/h2-8H,9H2,1H3,(H,16,17,19)
InChIKeyNRQCBVUUIJSMDI-UHFFFAOYSA-N
MW267.29 g/mol
LogP2.71
Rot. Bonds3

About 2-(5-methyl-1,2-benzoxazol-3-yl)-N-pyridin-2-ylacetamide

2-(5-methyl-1,2-benzoxazol-3-yl)-N-pyridin-2-ylacetamide (PubChem CID 22519774) has the molecular formula C15H13N3O2 and a molecular weight of 267.29 g/mol. Its IUPAC name is 2-(5-methyl-1,2-benzoxazol-3-yl)-N-pyridin-2-ylacetamide.

Molecular Properties

Compound Name2-(5-methyl-1,2-benzoxazol-3-yl)-N-pyridin-2-ylacetamide
PubChem CID22519774
Molecular FormulaC15H13N3O2
Molecular Weight267.29 g/mol
Exact Mass267.10
IUPAC Name2-(5-methyl-1,2-benzoxazol-3-yl)-N-pyridin-2-ylacetamide
SMILESCc1ccc2onc(CC(=O)Nc3ccccn3)c2c1
InChIInChI=1S/C15H13N3O2/c1-10-5-6-13-11(8-10)12(18-20-13)9-15(19)17-14-4-2-3-7-16-14/h2-8H,9H2,1H3,(H,16,17,19)
InChIKeyNRQCBVUUIJSMDI-UHFFFAOYSA-N
XLogP2.71
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.29
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(5-methyl-1,2-benzoxazol-3-yl)-N-(2-methylphenyl)acetamide
CID 22519860
2-[[2-(5-methyl-1,2-benzoxazol-3-yl)acetyl]amino]benzoic acid
CID 108803274
N-ethyl-2-(5-methyl-1,2-benzoxazol-3-yl)acetamide
CID 108790457
N-(4-cyano-1-pyridin-2-ylpyrazol-5-yl)-2-(5-methyl-1,2-benzoxazol-3-yl)acetamide
CID 108738156
2-(5-methyl-1,2-benzoxazol-3-yl)-N-[(1S)-1-phenylethyl]acetamide
CID 40647250
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-(5-methyl-2-phenylpyrazol-3-yl)acetamide
CID 108803231
N-(3-fluoro-4-methylphenyl)-2-(5-methyl-1,2-benzoxazol-3-yl)acetamide
CID 22519775
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-[3-[(4,6-dimethylpyrimidin-2-yl)amino]phenyl]-2-(5-methyl-1,2-benzoxazol-3-yl)acetamide
CID 108746218
2-(1,2-benzoxazol-3-yl)-N-(3-methyl-2-pyridinyl)acetamide
CID 22519739

Frequently Asked Questions

What is the IUPAC name of 2-(5-methyl-1,2-benzoxazol-3-yl)-N-pyridin-2-ylacetamide?
The IUPAC name of 2-(5-methyl-1,2-benzoxazol-3-yl)-N-pyridin-2-ylacetamide (CID 22519774) is 2-(5-methyl-1,2-benzoxazol-3-yl)-N-pyridin-2-ylacetamide.
What is the SMILES notation for 2-(5-methyl-1,2-benzoxazol-3-yl)-N-pyridin-2-ylacetamide?
The canonical SMILES for 2-(5-methyl-1,2-benzoxazol-3-yl)-N-pyridin-2-ylacetamide is Cc1ccc2onc(CC(=O)Nc3ccccn3)c2c1.
What is the InChIKey of 2-(5-methyl-1,2-benzoxazol-3-yl)-N-pyridin-2-ylacetamide?
The InChIKey is NRQCBVUUIJSMDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3O2/c1-10-5-6-13-11(8-10)12(18-20-13)9-15(19)17-14-4-2-3-7-16-14/h2-8H,9H2,1H3,(H,16,17,19).
What are the key properties of 2-(5-methyl-1,2-benzoxazol-3-yl)-N-pyridin-2-ylacetamide?
2-(5-methyl-1,2-benzoxazol-3-yl)-N-pyridin-2-ylacetamide has a molecular weight of 267.29 g/mol, XLogP of 2.71, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-methyl-1,2-benzoxazol-3-yl)-N-pyridin-2-ylacetamide is sourced from PubChem (CID 22519774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).