3-(4-Pyridin-3-yl-phenyl)propionic acid ethyl ester

HCID 69300076
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Basic information

Standard SMILES
CCOC(=O)CCc1ccc(-c2cccnc2)cc1
InChIKey
UATYRQSJXRQLKO-UHFFFAOYSA-N
Molecular formula
C16H17NO2
Average molar mass
255.31 g/mol
Monoisotopic mass
255.12592879

Names & identifiers

Preferred name
3-(4-Pyridin-3-yl-phenyl)propionic acid ethyl ester
IUPAC
ethyl 3-(4-pyridin-3-ylphenyl)propanoate

Names & synonyms

SCHEMBL5068360UATYRQSJXRQLKO-UHFFFAOYSA-N3-(4-Pyridin-3-yl-phenyl)propionic acid ethyl ester

Database identifiers

PubChem CID
69300076

Properties

Computed structural properties

XLogP
2.9
Topological polar surface area
39.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
6
Heavy atoms
19

Related reactions

2 records
New reaction record

Compound notes

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