General Information of the Compound
| Compound ID |
CP0439422
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| Compound Name |
2pyrrolidin-1-yl-1-phenylpentan-1-one
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| Synonyms |
1-Pentanone, 1-phenyl-2-(1-pyrrolidinyl)-
1-Phenyl-2-(pyrrolidin-1-yl)pentan-1-one
1-phenyl-2-(1-pyrrolidinyl)-1-pentanone
14530-33-7
2pyrrolidin-1-yl-1-phenylpentan-1-one
Alpha-Pyrrolidinopentiophenone
BDBM50182584
CHEMBL205082
DTXSID70456954
Desmethyl pyrovalerone
Flakka
Gravel
MFCD24386810
O-2387
Prolintanone
SCHEMBL4936204
YDIIDRWHPFMLGR-UHFFFAOYSA-N
a-PVP
a-Pyrrolidinopentiophenone
alpha-PVP
alpha-Pyrrolidinopentiophenone, a-PVP
alpha-pyrrolidinovalerophenone
beta-Keto-prolintane
beta-Ketone-prolintane
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| Structure |
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| Formula |
C15H21NO
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| Molecular Weight |
231.339
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| Canonical SMILES |
CCCC(N1CCCC1)C(=O)c1ccccc1
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| InChI |
InChI=1S/C15H21NO/c1-2-8-14(16-11-6-7-12-16)15(17)13-9-4-3-5-10-13/h3-5,9-10,14H,2,6-8,11-12H2,1H3
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| InChIKey |
YDIIDRWHPFMLGR-UHFFFAOYSA-N
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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
Protein ID: PT00871, Sodium-dependent serotonin transporter
Clinical Information about the Compound