Phenyramidol Hydrochloride
PubChem CID: 9469
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| Compound Synonyms | Phenyramidol hydrochloride, 326-43-2, Fenyramidol hydrochloride, Abbolexin, Analexin, Betapirin, Firmalgil, Vazalmin, Verbanol, Miodar, Phenyramidol HCl, Cabral hydrochloride, Phenylramidol hydrochloride, Elan, NSC-17777, Fenyramidol hcl, Evasprine hydrochloride, IN 511 hydrochloride, Phenyramidol hydrochloride [USAN], IN 511, MJ 505, EINECS 206-308-3, UNII-M574V6XQH7, M574V6XQH7, 1-phenyl-2-(pyridin-2-ylamino)ethanol hydrochloride, ALPHA-[(2-PYRIDYLAMINO)METHYL]BENZYL ALCOHOL MONOHYDROCHLORIDE, Benzenemethanol, alpha-((2-pyridinylamino)methyl)-, monohydrochloride, IN-511, alpha-((2-Pyridylamino)methyl)-benzyl alcohol hydrochloride, alpha-((2-Pyridylamino)methyl)benzyl alcohol monohydrochloride, Benzyl alcohol, alpha-(2-pyridyl-aminomethyl)-, hydrochloride, Phenyramidol Hydrochloride (USAN), PHENYRAMIDOL HYDROCHLORIDE [MI], 326-43-2 (HCl), FENYRAMIDOL HYDROCHLORIDE [MART.], FENYRAMIDOL HYDROCHLORIDE [WHO-DD], NSC17777, BENZYL ALCOHOL, alpha-((2-PYRIDYLAMINO)METHYL)-, MONOHYDROCHLORIDE, BENZENEMETHANOL, .ALPHA.-((2-PYRIDINYLAMINO)METHYL)-, MONOHYDROCHLORIDE, FENYRAMIDOL HYDROCHLORIDE (MART.), .alpha.-[(2-Pyridylamino)methyl]benzyl alcohol monohydrochloride, .ALPHA.-((2-PYRIDYLAMINO)METHYL)BENZYL ALCOHOL MONOHYDROCHLORIDE, SCHEMBL121004, CHEMBL1996759, WLN: T6NJ BM1YQR & GH, AKOS027382007, DB-243033, NS00041837, D00755, 1-phenyl-2-(pyridin-2-ylamino)ethanol, hydrochloride, 1-phenyl-2-(pyridin-2-ylamino)ethanolhydrochloride, Q27283510, 1-phenyl-2-[(pyridin-2-yl)amino]ethan-1-ol hydrochloride, .alpha.-[(2-Pyridylamino)methyl]benzyl alcohol hydrochloride |
|---|---|
| Ghose Rule | True |
| Classyfire Kingdom | Organic compounds |
| Topological Polar Surface Area | 45.2 |
| Hydrogen Bond Donor Count | 3.0 |
| Pfizer 3 75 Rule | False |
| Scaffold Graph Level | C1CCC(CCCC2CCCCC2)CC1 |
| Deep Smiles | OCcccccc6))))))CNcccccn6.Cl |
| Heavy Atom Count | 17.0 |
| Classyfire Class | Pyridines and derivatives |
| Scaffold Graph Node Level | C1CCC(CCNC2CCCCN2)CC1 |
| Classyfire Subclass | Aminopyridines and derivatives |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 192.0 |
| Database Name | imppat_phytochem;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 1-phenyl-2-(pyridin-2-ylamino)ethanol, hydrochloride |
| Veber Rule | True |
| Classyfire Superclass | Organoheterocyclic compounds |
| Gsk 4 400 Rule | True |
| Molecular Formula | C13H15ClN2O |
| Scaffold Graph Node Bond Level | c1ccc(CCNc2ccccn2)cc1 |
| Inchi Key | HYYDHUILGLWOOP-UHFFFAOYSA-N |
| Silicos It Class | Moderately soluble |
| Rotatable Bond Count | 4.0 |
| Synonyms | verbanol |
| Esol Class | Soluble |
| Functional Groups | CO, Cl, cNC, cnc |
| Compound Name | Phenyramidol Hydrochloride |
| Exact Mass | 250.087 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 250.087 |
| Hydrogen Bond Acceptor Count | 3.0 |
| Molecular Weight | 250.72 |
| Gi Absorption | True |
| Covalent Unit Count | 2.0 |
| Total Atom Stereocenter Count | 1.0 |
| Total Bond Stereocenter Count | 0.0 |
| Lipinski Rule Of 5 | True |
| Inchi | InChI=1S/C13H14N2O.ClH/c16-12(11-6-2-1-3-7-11)10-15-13-8-4-5-9-14-13, /h1-9,12,16H,10H2,(H,14,15), 1H |
| Smiles | C1=CC=C(C=C1)C(CNC2=CC=CC=N2)O.Cl |
| Np Classifier Biosynthetic Pathway | Alkaloids |
| Defined Bond Stereocenter Count | 0.0 |
| Egan Rule | True |
- 1. Outgoing r'ship
FOUND_INto/from Artemisia Annua (Plant) Rel Props:Reference:https://doi.org/10.1080/0972060x.2014.895181 - 2. Outgoing r'ship
FOUND_INto/from Artemisia Persica (Plant) Rel Props:Reference:https://doi.org/10.1080/0972060x.2014.895181 - 3. Outgoing r'ship
FOUND_INto/from Artemisia Scoparia (Plant) Rel Props:Reference:https://doi.org/10.1080/0972060x.2014.895181 - 4. Outgoing r'ship
FOUND_INto/from Artemisia Vulgaris (Plant) Rel Props:Reference:https://doi.org/10.1080/0972060x.2014.895181 - 5. Outgoing r'ship
FOUND_INto/from Lantana Camara (Plant) Rel Props:Reference:https://doi.org/10.1002/ffj.1553 - 6. Outgoing r'ship
FOUND_INto/from Leonotis Nepetifolia (Plant) Rel Props:Reference:https://doi.org/10.1080/10412905.1999.9712003