General Information of the Compound
Compound ID
CP0061753
Compound Name
1-NP
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Synonyms
1-NP
1-(1-Naphthyl)piperazine
1-(naphth-1-yl)piperazine
1-(naphthalen-1-yl)piperazine
1-Naphthalen-1-yl-piperazine
1-Naphthylpiperazine
1-naphthalen-1-ylpiperazine
1-naphthylpiperazine
4-(1-naphthyl) piperazine
4-(1-naphthyl)piperazine
4-(naphth-1-yl)piperazine
57536-86-4
AC1L1B9K
AC1Q1INU
Biomol-NT_000100
CHEMBL277120
GTPL3
Lopac-S-003
N-(1- naphthyl)piperazine
N-(1-naphthyl) piperazine
N-(1-naphthyl)-piperazine
N-(1-naphthyl)piperazine
Naphthylpiperazine
Oprea1_621306
Piperazine, 1-(1-naphthalenyl)-
Piperazine,1-(1-naphthalenyl)-
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Structure
Formula
C14H16N2
Molecular Weight
212.296
Canonical SMILES
C1CN(CCN1)c1cccc2ccccc12
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InChI
InChI=1S/C14H16N2/c1-2-6-13-12(4-1)5-3-7-14(13)16-10-8-15-9-11-16/h1-7,15H,8-11H2
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InChIKey
VNICFCQJUVFULD-UHFFFAOYSA-N
CAS
57536-86-4
Physicochemical Property
logP
2.2494
Rotatable Bonds
1
Heavy Atom Count
16
Polar Areas
15.27
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
2
Complexity
16

"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: 1342
SID: 15195770
ChEMBL ID
CHEMBL277120
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: PT00819, 5-hydroxytryptamine receptor 1A
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000017 HeLa Homo sapiens (Human)  1
1
Ki = 9.2 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 Ki = 9.23 nM
Protein ID: PT01202, 5-hydroxytryptamine receptor 1B
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000011 CHO Cricetulus griseus (Chinese hamster)  1
1
EC50 > 10000 nM
   TI
   LI
   LO
   TS
CL000053 COS-7 Chlorocebus aethiops (Green monkey)  1
1
Ki = 10.1 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 Ki = 10.6 nM
Protein ID: PT00827, 5-hydroxytryptamine receptor 1D
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000053 COS-7 Chlorocebus aethiops (Green monkey)  1
1
Ki = 6.2 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 Ki = 6.18 nM
Protein ID: PT01746, 5-hydroxytryptamine receptor 7
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000053 COS-7 Chlorocebus aethiops (Green monkey)  1
1
Ki = 83 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 Ki = 18.2 nM
Protein ID: PT01065, Serine/threonine-protein kinase mTOR
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL001056 MEF-1 [Mouse fibroblast] Mus musculus (Mouse)  1
1
Potency = 16481.6 nM
   TI
   LI
   LO
   TS
Clinical Information about the Compound
Drug 1 ( 1-naphthylpiperazine )
Drug Name 1-naphthylpiperazine
Target(s)
5-HT 1E receptor (HTR1E)
Antagonist
5-HT 2A receptor (HTR2A)
Inhibitor
5-HT 2B receptor (HTR2B)
Antagonist
5-HT 1B receptor (HTR1B)
Agonist
5-HT 1F receptor (HTR1F)
Antagonist
5-HT 1D receptor (HTR1D)
Agonist
5-HT 6 receptor (HTR6)
Agonist
5-HT 1A receptor (HTR1A)
Agonist
5-HT 7 receptor (HTR7)
Agonist