ethyl (2R)-2-acetylamino-3-(3-cyanophenyl)propanoate

HCID 86584426
Substructure searchFind similar structures

Basic information

Standard SMILES
CCOC(=O)[C@@H](Cc1cccc(C#N)c1)NC(C)=O
InChIKey
QBWUCHFLLRXOFO-CYBMUJFWSA-N
Molecular formula
C14H16N2O3
Average molar mass
260.29 g/mol

Names & identifiers

Preferred name
ethyl (2R)-2-acetylamino-3-(3-cyanophenyl)propanoate
IUPAC
ethyl (2R)-2-acetamido-3-(3-cyanophenyl)propanoate

Names & synonyms

SCHEMBL27561728QBWUCHFLLRXOFO-CYBMUJFWSA-Nethyl (2R)-2-acetylamino-3-(3-cyanophenyl)propanoate

Database identifiers

PubChem CID
86584426

Properties

Computed structural properties

XLogP
1.5
Topological polar surface area
79.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
6
Heavy atoms
19

Related reactions

4 records
New reaction record

Linked notes

Loading…