2-(4-(adamantan-1-yl)phenoxy)-N,N-dimethylacetamide

HCID 71542010
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Basic information

Standard SMILES
CN(C)C(=O)COc1ccc(C23CC4CC(CC(C4)C2)C3)cc1
InChIKey
OSAYKMQQLGCOJQ-UHFFFAOYSA-N
Molecular formula
C20H27NO2
Average molar mass
313.4 g/mol
Monoisotopic mass
313.2041791

Names & identifiers

Preferred name
2-(4-(adamantan-1-yl)phenoxy)-N,N-dimethylacetamide
IUPAC
2-[4-(1-adamantyl)phenoxy]-N,N-dimethylacetamide

Names & synonyms

SCHEMBL14829104OSAYKMQQLGCOJQ-UHFFFAOYSA-N2-(4-(adamantan-1-yl)phenoxy)-N,N-dimethylacetamide

Database identifiers

PubChem CID
71542010

Properties

Computed structural properties

XLogP
4.2
Topological polar surface area
29.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
4
Heavy atoms
23

Related reactions

1 records
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Compound notes

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