IUPAC name
pentyl nitrite
SMILES
CCCCCON=O
Compound class
Vasodilator Agents; Antidotes;
Therapeutic area
For the rapid relief of angina pectoris.
Common name
Amyl Nitrite
IUPAC name
pentyl nitrite
SMILES
CCCCCON=O
INCHI
InChI=1S/C5H11NO2/c1-2-3-4-5-8-6-7/h2-5H2,1H3
FORMULA
C5H11NO2
Common name
Amyl Nitrite
IUPAC name
pentyl nitrite
Molecular weight
117.146
clogP
1.136
clogS
-1.526
HBond Acceptor
3
HBond Donor
0
Total Polar Surface Area
38.66
Number of Rings
0
Rotatable Bond
5
| Drug ID | Common name | Structure CAS | SMILE | Frequency |
|---|---|---|---|---|
| FDBF00007 | propane |
|
C(C)C | 0.2412 |
| FDBF00018 | propan-1-ol |
|
C(O)CC | 0.0330 |
| FDBF00041 | ethanol |
|
CCO | 0.1474 |
| FDBF00067 | butane |
|
CCCC | 0.0680 |
| FDBF00081 | pentane |
|
CCCCC | 0.0316 |
| FDBF00795 | pentan-1-ol |
|
OCCCCC | 0.0038 |
| FDBF03111 | N-methoxyhydroxylamine |
|
CONO | 0.0003 |
| FDBF03112 | N-ethoxyhydroxylamine |
|
C(C)ONO | 0.0003 |
| FDBF03113 | N-propoxyhydroxylamine |
|
C(CC)ONO | 0.0003 |
10 ,
2
