General Information of the Compound
Compound ID
CP0127278
Compound Name
2-methyl-1-phenylpropan-2-amine
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Synonyms
(alpha,alpha)-Dimethylphenethylamine
1,1-Dimethyl-2-phenylethylamine
1-(2-Methylphenyl)-2-propylamin
1-(2-Tolyl)-2-propylamine
2-Amino-2-methyl-1-phenylpropane
2-Methyl-1-phenyl-2-propanamine
2-Phenyl-tert-butylamine
Adipex P (TN)
Adipex-P
Alpha,alpha-Dimethyl-beta-phenylethylamine
Alpha,alpha-Dimethylbenzeneethanamine
Alpha,alpha-Dimethylphenethylamine
Alpha-Benzylisopropylamine
Alpha.,.alpha.-dimethyl-Benzeneethanamine
AmbkkkkK744
Anoxine-AM (TN)
Duromine
Duromine (TN)
Fastin
Fastin (TN)
Fentermina
Fentermina [INN-Spanish]
Inoamin
Ionamin
Ionamin (TN)
Ionamine
Linyl
Lipopill
Lonamin
Mirapront
Mirapront (TN)
Normephentermine
Obenix
Obenix (TN)
Obephen (TN)
Obermine
Obermine (TN)
Obestin-30 (TN)
Oby-Trim
Oby-Trim (TN)
Omnibex
Ona Mast
Ortetamin
Ortetamina
Ortetamine [INN]
Ortetaminum
Panbesy (TN)
Phentercot
Phenterex (TN)
Phentermine
Phentermine (TN)
Phentermine (USAN/INN)
Phentermine HCl
Phentermine Resin 30
Phentermine [USAN:INN:BAN]
Phentermine resin complex
Phenterminum
Phenterminum [INN-Latin]
Phentremene (TN)
Phentride
Phentrol
Phentrol (TN)
Phentrol 2
Phentrol 3
Phentrol 4
Phentromin (TN)
Phenyl-tert-butylamine
Phenyl-tertiary-butylamine
Pro-Fast
Pro-Fast SA (TN)
Redusa (TN)
Sinpet (TN)
Supremin (TN)
Teramine (TN)
Trenker (TN)
Umine (TN)
Weltmine (TN)
Wilpo
Zantryl
Zantryl (TN)
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Structure
Formula
C10H15N
Molecular Weight
149.237
Canonical SMILES
CC(C)(N)Cc1ccccc1
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InChI
InChI=1S/C10H15N/c1-10(2,11)8-9-6-4-3-5-7-9/h3-7H,8,11H2,1-2H3
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InChIKey
DHHVAGZRUROJKS-UHFFFAOYSA-N
CAS
12674-13-4
122-09-8
9008-94-0
Physicochemical Property
logP
1.9664
Rotatable Bonds
2
Heavy Atom Count
11
Polar Areas
26.02
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
1
Complexity
11

"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).

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PubChem ID
CID: 4771
SID: 15194700
ChEMBL ID
CHEMBL1574
DrugBank ID
DB00191
Map of Molecular Bioactivity Related to the Compound
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
Table of Molecular Bioactivities Related to the Compound
Protein ID: PT04763, Trace amine-associated receptor 1
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000026 CHO-K1 Cricetulus griseus (Chinese hamster)  1
1
EC50 = 5470 nM
   TI
   LI
   LO
   TS
Clinical Information about the Compound
Drug 1 ( Phentermine )
Drug Name Phentermine
Company Medeva Pharmaceuticals
Indication
Obesity
Approved
Target(s)
Norepinephrine transporter (NET)
Inhibitor