IUPAC name
2-hydroxy-3-(2-methoxyphenoxy)propyl carbamate
SMILES
COC1=CC=CC=C1OCC(O)COC(N)=O
Compound class
Muscle Relaxants, Central; Musculo-Skeletal System; Muscle Relaxants, Centrally Acting Agents; Muscle Relaxants; Carbamic Acid Esters;
Therapeutic area
For use as an adjunct to rest, physical therapy, and other measures for the relief of discomforts associated with acute, painful musculoskeletal conditions.
Common name
Methocarbamol
IUPAC name
2-hydroxy-3-(2-methoxyphenoxy)propyl carbamate
SMILES
COC1=CC=CC=C1OCC(O)COC(N)=O
INCHI
InChI=1S/C11H15NO5/c1-15-9-4-2-3-5-10(9)16-6-8(13)7-17-11(12)14/h2-5,8,13H,6-7H2,1H3,(H2,12,14)
FORMULA
C11H15NO5
Common name
Methocarbamol
IUPAC name
2-hydroxy-3-(2-methoxyphenoxy)propyl carbamate
Molecular weight
241.241
clogP
0.407
clogS
-1.280
HBond Acceptor
5
HBond Donor
3
Total Polar Surface Area
91.01
Number of Rings
1
Rotatable Bond
7
| Drug ID | Common name | Structure CAS | SMILE | Frequency |
|---|---|---|---|---|
| FDBF00005 | benzene |
|
c1ccccc1 | 0.2824 |
| FDBF00041 | ethanol |
|
CCO | 0.1474 |
| FDBF00042 | propan-2-ol |
|
CC(O)C | 0.0278 |
| FDBF00065 | ethylene glycol |
|
C(O)CO | 0.0265 |
| FDBF00211 | anisole |
|
COc1ccccc1 | 0.0423 |
| FDBF00214 | (2R)-propane-1,2-diol |
|
CC(CO)O | 0.0100 |
| FDBF00220 | (2R)-1-phenoxypropan-2-ol |
|
CC(COc1ccccc1)O | 0.0045 |
| FDBF00297 | 1,2-dimethoxybenzene |
|
O(C)c1ccccc1OC | 0.0093 |
| FDBF00477 | 2-methoxyphenol |
|
c1(c(cccc1)O)OC | 0.0079 |
| FDBF00692 | methyl carbamate |
|
O(C(=O)N)C | 0.0117 |
12 ,
2
