
Common name
N-[(3S)-2-oxooxolan-3-yl]acetamide
IUPAC name
N-[(3S)-2-oxooxolan-3-yl]acetamide
SMILES
CC(=O)N[C@@H]1C(=O)OCC1
Common name
N-[(3S)-2-oxooxolan-3-yl]acetamide
IUPAC name
N-[(3S)-2-oxooxolan-3-yl]acetamide
SMILES
CC(=O)N[C@@H]1C(=O)OCC1
INCHI
InChI=1S/C6H9NO3/c1-4(8)7-5-2-3-10-6(5)9/h5H,2-3H2,1H3,(H,7,8)/t5-/m0/s1
FORMULA
C6H9NO3

Common name
N-[(3S)-2-oxooxolan-3-yl]acetamide
IUPAC name
N-[(3S)-2-oxooxolan-3-yl]acetamide
Molecular weight
143.141
clogP
0.340
clogS
-0.751
Frequency
0.0003
HBond Acceptor
3
HBond Donor
1
Total PolarSurface Area
55.4
Number of Rings
1
Rotatable Bond
1
1 ,
1
FRAGNAME | PDBID | SIMILIRITY | XSCORE | SMILE | HAC |
---|---|---|---|---|---|
3e0p_ligand_4_310.mol2 | 3e0p | 0.661017 | -5.62 | CO[C@@H]1CCN(C1)C(=O)CC | 11 |
1heg_ligand_3_435.mol2 | 1heg | 0.642857 | -6.09 | [C@@H]1(CCOC(=O)[C@H]1NC(=O)C)C | 12 |
3e0p_ligand_3_130.mol2 | 3e0p | 0.637931 | -5.48 | CO[C@@H]1CCN(C1)C(=O)C | 10 |
2oc7_ligand_1_3.mol2 | 2oc7 | 0.626866 | -6.14 | CC(=O)N1C[C@H]2[C@@H](C1)C(O2)(C)C | 12 |
2vcg_ligand_3_36.mol2 | 2vcg | 0.622642 | -6.00 | [C@H](C(=O)OC)(NC(=O)C)C | 10 |
4l7u_ligand_3_10.mol2 | 4l7u | 0.622642 | -5.80 | C[C@@H](C(=O)OC)NC(=O)C | 10 |
130 ,
14