Common name
1-methylpyrrolidin-2-one
IUPAC name
1-methylpyrrolidin-2-one
SMILES
CN1C(=O)CCC1
Common name
1-methylpyrrolidin-2-one
IUPAC name
1-methylpyrrolidin-2-one
SMILES
CN1C(=O)CCC1
INCHI
InChI=1S/C5H9NO/c1-6-4-2-3-5(6)7/h2-4H2,1H3
FORMULA
C5H9NO
Common name
1-methylpyrrolidin-2-one
IUPAC name
1-methylpyrrolidin-2-one
Molecular weight
99.131
clogP
0.845
clogS
-0.521
Frequency
0.0007
HBond Acceptor
1
HBond Donor
0
Total PolarSurface Area
20.31
Number of Rings
1
Rotatable Bond
0
| Drug ID | Common name | Structure CAS | Compound class | Therapeutic area |
|---|---|---|---|---|
| FDBD01048 | Levetiracetam |
|
Nootropic Agents; Anticonvulsants; Nervous System; Antiepileptics; | Used as adjunctive therapy in the treatment of partial onset seizures in adults and children 4 years of age and older with epilepsy. |
| FDBD01740 | Piracetam |
|
Nootropic Agents; Neuroprotective Agents; Nervous System; Psychoanaleptics; Psychostimulants, Agents Used for Adhd and Nootropics; | For the treatment of myoclonus (brief, involuntary twitching of a muscle or a group of muscles). |
2 ,
1
| FRAGNAME | PDBID | SIMILIRITY | XSCORE | SMILE | HAC |
|---|---|---|---|---|---|
| 1b6k_ligand_1_0.mol2 | 1b6k | 1 | -5.57 | C1CC(=O)N(C1)C | 7 |
| 1f0s_ligand_1_2.mol2 | 1f0s | 1 | -5.55 | CN1C(=O)CCC1 | 7 |
| 1f0r_ligand_1_1.mol2 | 1f0r | 1 | -5.47 | N1(CCCC1=O)C | 7 |
| 4ff8_ligand_1_0.mol2 | 4ff8 | 1 | -5.41 | O=C1CCCN1C | 7 |
| 1f0t_ligand_1_1.mol2 | 1f0t | 1 | -5.37 | CN1CCCC1=O | 7 |
104 ,
11
