2-(1-Acetylpiperidin-4-yl)benzoxazole-4-carboxylic acid

HCID 68995336
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Basic information

Standard SMILES
CC(=O)N1CCC(c2nc3c(C(=O)O)cccc3o2)CC1
InChIKey
AYYHPVNDVPYAIZ-UHFFFAOYSA-N
Molecular formula
C15H16N2O4
Average molar mass
288.3 g/mol
Monoisotopic mass
288.111007

Names & identifiers

Preferred name
2-(1-Acetylpiperidin-4-yl)benzoxazole-4-carboxylic acid
IUPAC
2-(1-acetylpiperidin-4-yl)-1,3-benzoxazole-4-carboxylic acid

Names & synonyms

SCHEMBL4305393AYYHPVNDVPYAIZ-UHFFFAOYSA-N2-(1-acetylpiperidin-4-yl)benzoxazole-4-carboxylic acid

Database identifiers

PubChem CID
68995336

Properties

Computed structural properties

XLogP
1.4
Topological polar surface area
83.6 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
2
Heavy atoms
21

Related reactions

2 records
New reaction record

Compound notes

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