IUPAC name
2-[5-methyl-2-(propan-2-yl)phenoxymethyl]-4,5-dihydro-1H-imidazole
SMILES
CC(C)C1=C(OCC2=NCCN2)C=C(C)C=C1
Compound class
Respiratory System; Nasal Preparations; Sympathomimetics, Plain;
Therapeutic area
For the treatment of Inflammation of the lining of the nose and paranasal sinuses and allergic inflammation of nasopharyngeal.
Common name
Tymazoline
IUPAC name
2-[5-methyl-2-(propan-2-yl)phenoxymethyl]-4,5-dihydro-1H-imidazole
SMILES
CC(C)C1=C(OCC2=NCCN2)C=C(C)C=C1
INCHI
InChI=1S/C14H20N2O/c1-10(2)12-5-4-11(3)8-13(12)17-9-14-15-6-7-16-14/h4-5,8,10H,6-7,9H2,1-3H3,(H,15,16)
FORMULA
C14H20N2O
Common name
Tymazoline
IUPAC name
2-[5-methyl-2-(propan-2-yl)phenoxymethyl]-4,5-dihydro-1H-imidazole
Molecular weight
232.321
clogP
3.966
clogS
-4.221
HBond Acceptor
2
HBond Donor
1
Total Polar Surface Area
33.62
Number of Rings
2
Rotatable Bond
4
| Drug ID | Common name | Structure CAS | SMILE | Frequency |
|---|---|---|---|---|
| FDBF00007 | propane |
|
C(C)C | 0.2412 |
| FDBF00011 | imidazole |
|
[nH]1ccnc1 | 0.0175 |
| FDBF00023 | toluene |
|
c1(ccccc1)C | 0.1268 |
| FDBF00958 | 1-methoxy-3-methyl-benzene |
|
Cc1cccc(c1)OC | 0.0038 |
| FDBF01611 | 2-methyl-1H-imidazole |
|
Cc1[nH]ccn1 | 0.0038 |
| FDBF02914 | m-cresol |
|
Oc1cc(ccc1)C | 0.0069 |
| FDBF03650 | 2-isopropyl-5-methyl-phenol |
|
c1(c(cc(cc1)C)O)C(C)C | 0.0003 |
| FDBF03651 | 1H-imidazol-2-ylmethanol |
|
[nH]1c(ncc1)CO | 0.0003 |
| FDBF03652 | 2-[(3-methylphenoxy)methyl]-1H-imidazole |
|
c1c(cc(cc1)C)OCc2[nH]ccn2 | 0.0003 |
9 ,
1
