IUPAC name
propyl N-[3-(dimethylamino)propyl]carbamate
SMILES
CCCOC(=O)NCCCN(C)C
Compound class
Fungicide
Therapeutic area
Fungicide
Common name
propamocarb
IUPAC name
propyl N-[3-(dimethylamino)propyl]carbamate
SMILES
CCCOC(=O)NCCCN(C)C
INCHI
InChI=1S/C9H20N2O2/c1-4-8-13-9(12)10-6-5-7-11(2)3/h4-8H2,1-3H3,(H,10,12)
FORMULA
C9H20N2O2
Common name
propamocarb
IUPAC name
propyl N-[3-(dimethylamino)propyl]carbamate
Molecular weight
188.267
clogP
0.977
clogS
-1.663
HBond Acceptor
4
HBond Donor
1
Total Polar Surface Area
45.06
Number of Rings
0
Rotatable Bond
7
| Drug ID | Common name | Structure CAS | SMILE | Frequency |
|---|---|---|---|---|
| FDBF00007 | propane |
|
C(C)C | 0.2412 |
| FDBF00064 | N,N-dimethylmethanamine |
|
N(C)(C)C | 0.0371 |
| FDBF00289 | N,N-dimethylethanamine |
|
C(C)N(C)C | 0.0299 |
| FDBF00377 | N,N-dimethylpropan-1-amine |
|
N(C)(C)CCC | 0.0113 |
| FDBF00692 | methyl carbamate |
|
O(C(=O)N)C | 0.0117 |
| FDBF01127 | methylcarbamic acid |
|
O=C(O)NC | 0.0199 |
| FDBF01131 | methyl N-methylcarbamate |
|
O(C(=O)NC)C | 0.0048 |
| FDBF01140 | methyl N-ethylcarbamate |
|
O(C(=O)NCC)C | 0.0017 |
| FDBF02923 | propylcarbamic acid |
|
CCCNC(=O)O | 0.0014 |
| FDBF04048 | methyl N-propylcarbamate |
|
CCCNC(=O)OC | 0.0007 |
14 ,
2
