2-adamantan-1-yl-N-(1-oxo-1H-isochromen-5-yl)-acetamide

HCID 59752015
NotesReactions
Substructure searchFind similar structures

Basic information

Standard SMILES
O=C(CC12CC3CC(CC(C3)C1)C2)Nc1cccc2c(=O)occc12
InChIKey
ZGSUXYLZKZQIBK-UHFFFAOYSA-N
Molecular formula
C21H23NO3
Average molar mass
337.4 g/mol

Names & identifiers

Preferred name
2-adamantan-1-yl-N-(1-oxo-1H-isochromen-5-yl)-acetamide
IUPAC
2-(1-adamantyl)-N-(1-oxoisochromen-5-yl)acetamide

Names & synonyms

SCHEMBL2998509ZGSUXYLZKZQIBK-UHFFFAOYSA-N2-adamantan-1-yl-N-(1-oxo-1H-isochromen-5-yl)-acetamide

Database identifiers

PubChem CID
59752015

Properties

Computed structural properties

XLogP
4.5
Topological polar surface area
55.4 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
3
Heavy atoms
25

Related reactions

3 records
New reaction record

Compound notes

Loading…