General Information of the Compound
| Compound ID |
CP0101880
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| Compound Name |
3-(2-methoxyphenoxy)-N-methyl-3-phenylpropan-1-amine
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| Synonyms |
3-(2-Methoxyphenoxy)-N-methyl-3-phenylpropylamine
3-(2-methoxyphenoxy)-N-methyl-3-phenylpropan-1-amine
3-(o-Methoxyphenoxy)-N-methyl-3-phenylpropylamine
53179-07-0
57226-61-6
57754-86-6
CHEBI:73410
CHEMBL295467
Compound 89218
DL-N-Methyl-3-(o-methoxyphenoxy)-N-methyl-3-phenylpropylamine
DSSTox_CID_25175
DSSTox_GSID_45175
DSSTox_RID_80724
ITJNARMNRKSWTA-UHFFFAOYSA-N
Lilly 94939
N-Methyl-gamma-(2-methylphenoxy)phenylpropanolamine
NCGC00015715-04
NISOXETINE
Nisoxetine
Nisoxetine Inhibitor
Nisoxetine [USAN:INN]
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| Structure |
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| Formula |
C17H21NO2
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| Molecular Weight |
271.36
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| Canonical SMILES |
CNCCC(Oc1ccccc1OC)c1ccccc1
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| InChI |
InChI=1S/C17H21NO2/c1-18-13-12-15(14-8-4-3-5-9-14)20-17-11-7-6-10-16(17)19-2/h3-11,15,18H,12-13H2,1-2H3
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| InChIKey |
ITJNARMNRKSWTA-UHFFFAOYSA-N
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| CAS |
53179-07-0
57226-61-6
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound
Protein ID: PT00884, Sodium-dependent dopamine transporter
Protein ID: PT01026, Sodium-dependent noradrenaline transporter
Cell-based Assay
Protein ID: PT00871, Sodium-dependent serotonin transporter
Clinical Information about the Compound