Molecular Identity
40077-13-2
2-[[2-(4-hydroxyphenyl)ethylamino]methyl]-3,4-dihydro-2H-naphthalen-1-one
PubChem CID: 34772
2-[[2-(4-hydroxyphenyl)ethylamino]methyl]-3,4-dihydro-2H-naphthalen-1-one is a member of tetralins.
2D Structure
Properties
C19H21NO2
Molecular Formula
295.40
Molecular Weight
g/mol
295.1572
Exact Mass
Da
3.8
XLogP
Drug-like (Lipinski: < 5)
49.3
TPSA
Good oral absorption (< 140 A²)
2
H-Bond Donors
3
H-Bond Acceptors
362
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(20)
40077-13-2BE 2254BE-22542-Heat1(2H)-Naphthalenone, 3,4-dihydro-2-(((2-(4-hydroxyphenyl)ethyl)amino)methyl)-RefChem:1168012-[[2-(4-hydroxyphenyl)ethylamino]methyl]-3,4-dihydro-2H-naphthalen-1-oneHEAT2-(beta-(4-Hydroxyphenyl)ethylaminomethyl)tetralone2-(((2-(4-Hydroxyphenyl)ethyl)amino)methyl)-3,4-dihydro-1(2H)-naphthalenoneBE22542-(((4-Hydroxyphenethyl)amino)methyl)-3,4-dihydronaphthalen-1(2H)-one2-[beta-(4-hydroxyphenyl)ethylaminomethyl]tetraloneorb1701089SCHEMBL6413372
Data from PubChem (NCBI)
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