IUPAC name
(1S,2S)-2-(methylamino)-1-phenylpropan-1-ol
SMILES
CN[C@@H](C)[C@@H](O)C1=CC=CC=C1
Compound class
Sympathomimetics; Bronchodilator Agents; Nasal Decongestants; Respiratory System; Nasal Preparations; Nasal Decongestants for Systemic Use; CYP2D6 Inducers; CYP2D6 Inducers (strong); Alpha2 Agonists;
Therapeutic area
For the treatment of nasal congestion, sinus congestion, Eustachian tube congestion, and vasomotor rhinitis, and as an adjunct to other agents in the optimum treatment of allergic rhinitis, croup, sinusitis, otitis media, and tracheobronchitis. Also used as first-line therapy of priapism.
Common name
Pseudoephedrine
IUPAC name
(1S,2S)-2-(methylamino)-1-phenylpropan-1-ol
SMILES
CN[C@@H](C)[C@@H](O)C1=CC=CC=C1
INCHI
InChI=1S/C10H15NO/c1-8(11-2)10(12)9-6-4-3-5-7-9/h3-8,10-12H,1-2H3/t8-,10+/m0/s1
FORMULA
C10H15NO
Common name
Pseudoephedrine
IUPAC name
(1S,2S)-2-(methylamino)-1-phenylpropan-1-ol
Molecular weight
165.232
clogP
1.565
clogS
-1.980
HBond Acceptor
1
HBond Donor
2
Total Polar Surface Area
32.26
Number of Rings
1
Rotatable Bond
3
| Drug ID | Common name | Structure CAS | SMILE | Frequency |
|---|---|---|---|---|
| FDBF00005 | benzene |
|
c1ccccc1 | 0.2824 |
| FDBF00018 | propan-1-ol |
|
C(O)CC | 0.0330 |
| FDBF00068 | N-methylethanamine |
|
N(CC)C | 0.0429 |
| FDBF00304 | phenylmethanol |
|
c1(ccccc1)CO | 0.0168 |
| FDBF00635 | (1R)-1-phenylpropan-1-ol |
|
C(C(O)c1ccccc1)C | 0.0017 |
| FDBF01908 | (2S)-2-(methylamino)propan-1-ol |
|
C(C)(NC)CO | 0.0010 |
