IUPAC name
1-(4-butoxyphenyl)-3-(piperidin-1-yl)propan-1-one
SMILES
CCCCOC1=CC=C(C=C1)C(=O)CCN1CCCCC1
Compound class
Anesthetics, Local; Anesthetics; Respiratory System; Throat Preparations; Nervous System;
Therapeutic area
Used to provide topical anesthesia of accessible mucous membranes prior to examination, endoscopy or instrumentation, or other procedures involving the esophagus, larynx, mouth, pharynx or throat, respiratory tract or trachea, urinary tract, or vagina. Also used to suppress the gag reflex and/or other laryngeal and esophageal reflexes to facilitate dental examination or procedures (including oral surgery), endoscopy, or intubation. Also used for relief of canker sores, cold sores or fever blister.
Common name
Dyclonine
IUPAC name
1-(4-butoxyphenyl)-3-(piperidin-1-yl)propan-1-one
SMILES
CCCCOC1=CC=C(C=C1)C(=O)CCN1CCCCC1
INCHI
InChI=1S/C18H27NO2/c1-2-3-15-21-17-9-7-16(8-10-17)18(20)11-14-19-12-5-4-6-13-19/h7-10H,2-6,11-15H2,1H3
FORMULA
C18H27NO2
Common name
Dyclonine
IUPAC name
1-(4-butoxyphenyl)-3-(piperidin-1-yl)propan-1-one
Molecular weight
289.412
clogP
4.288
clogS
-4.610
HBond Acceptor
3
HBond Donor
0
Total Polar Surface Area
29.54
Number of Rings
2
Rotatable Bond
8
| Drug ID | Common name | Structure CAS | SMILE | Frequency |
|---|---|---|---|---|
| FDBF00005 | benzene |
|
c1ccccc1 | 0.2824 |
| FDBF00007 | propane |
|
C(C)C | 0.2412 |
| FDBF00041 | ethanol |
|
CCO | 0.1474 |
| FDBF00098 | acetaldehyde |
|
CC=O | 0.0182 |
| FDBF00671 | 1-ethylpiperidine |
|
N1(CCCCC1)CC | 0.0106 |
| FDBF01007 | benzaldehyde |
|
c1(ccccc1)C=O | 0.0086 |
| FDBF01049 | 4-hydroxybenzaldehyde |
|
c1(ccc(cc1)C=O)O | 0.0014 |
| FDBF01471 | 3-(1-piperidyl)propanal |
|
C(CN1CCCCC1)C=O | 0.0003 |
| FDBF01473 | 1-(4-hydroxyphenyl)propan-1-one |
|
c1(ccc(cc1)O)C(=O)CC | 0.0003 |
| FDBF01476 | 1-(4-ethoxyphenyl)ethanone |
|
C(C)Oc1ccc(cc1)C(=O)C | 0.0007 |
