N-[2-(3-cyanophenoxy)ethyl]-4-cyanobenzamide

HCID 11066232
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Basic information

Standard SMILES
N#Cc1ccc(C(=O)NCCOc2cccc(C#N)c2)cc1
InChIKey
FSCCXSPDHMKXLM-UHFFFAOYSA-N
Molecular formula
C17H13N3O2
Average molar mass
291.3 g/mol
Monoisotopic mass
291.10077667

Names & identifiers

Preferred name
N-[2-(3-cyanophenoxy)ethyl]-4-cyanobenzamide
IUPAC
4-cyano-N-[2-(3-cyanophenoxy)ethyl]benzamide

Names & synonyms

SCHEMBL3897181FSCCXSPDHMKXLM-UHFFFAOYSA-NN-[2-(3-cyanophenoxy)ethyl]-4-cyanobenzamide

Database identifiers

PubChem CID
11066232

Properties

Computed structural properties

XLogP
2.3
Topological polar surface area
85.9 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
5
Heavy atoms
22

Related reactions

6 records
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Compound notes

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