Ethyl 2-[4-(2-acetaminoethyl)-phenoxy]-n-hexanoate

HCID 23471007
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Basic information

Standard SMILES
CCCCC(Oc1ccc(CCNC(C)=O)cc1)C(=O)OCC
InChIKey
MDWNDNFZBLYYDZ-UHFFFAOYSA-N
Molecular formula
C18H27NO4
Average molar mass
321.4 g/mol

Names & identifiers

Preferred name
Ethyl 2-[4-(2-acetaminoethyl)-phenoxy]-n-hexanoate
IUPAC
ethyl 2-[4-(2-acetamidoethyl)phenoxy]hexanoate

Names & synonyms

SCHEMBL11365130MDWNDNFZBLYYDZ-UHFFFAOYSA-Nethyl 2-[4-(2-acetaminoethyl)-phenoxy]-n-hexanoate

Database identifiers

PubChem CID
23471007

Properties

Computed structural properties

XLogP
3.6
Topological polar surface area
64.6 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
11
Heavy atoms
23

Related reactions

1 records
New reaction record

Compound notes

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