IUPAC name
2-(dimethylamino)ethyl 4-(butylamino)benzoate
SMILES
CCCCNC1=CC=C(C=C1)C(=O)OCCN(C)C
Compound class
Anesthetics, Local; Anesthetics; Ophthalmologicals; Sensory Organs; Dermatologicals; Nervous System; Cardiovascular System; Local Anesthetics; Agents for Treatment of Hemorrhoids and Anal Fissures for Topical Use; Vasoprotectives; Anesthetics for Topical Use; Antipruritics, Incl. Antihistamines, Anesthetics, Etc.; Esters of Aminobenzoic Acid;
Therapeutic area
Common name
Tetracaine
IUPAC name
2-(dimethylamino)ethyl 4-(butylamino)benzoate
SMILES
CCCCNC1=CC=C(C=C1)C(=O)OCCN(C)C
INCHI
InChI=1S/C15H24N2O2/c1-4-5-10-16-14-8-6-13(7-9-14)15(18)19-12-11-17(2)3/h6-9,16H,4-5,10-12H2,1-3H3
FORMULA
C15H24N2O2
Common name
Tetracaine
IUPAC name
2-(dimethylamino)ethyl 4-(butylamino)benzoate
Molecular weight
264.363
clogP
2.473
clogS
-4.057
HBond Acceptor
3
HBond Donor
1
Total Polar Surface Area
41.57
Number of Rings
1
Rotatable Bond
9
| Drug ID | Common name | Structure CAS | SMILE | Frequency |
|---|---|---|---|---|
| FDBF00030 | butan-1-amine |
|
C(CCN)C | 0.0106 |
| FDBF00049 | N-methylaniline |
|
CNc1ccccc1 | 0.0076 |
| FDBF00066 | N-methylmethanamine |
|
N(C)C | 0.0914 |
| FDBF00067 | butane |
|
CCCC | 0.0680 |
| FDBF01034 | ethyl benzoate |
|
c1(ccccc1)C(=O)OCC | 0.0024 |
| FDBF01560 | methyl benzoate |
|
O(C(=O)c1ccccc1)C | 0.0038 |
| FDBF01682 | methyl 4-aminobenzoate |
|
Nc1ccc(cc1)C(=O)OC | 0.0021 |
17 ,
2
