About 2-phenylmorpholin-4-amine;hydrochloride
2-phenylmorpholin-4-amine;hydrochloride (PubChem CID 54605145) has the molecular formula C10H15ClN2O
and a molecular weight of 214.70 g/mol. Its IUPAC name is 2-phenylmorpholin-4-amine;hydrochloride.
Molecular Properties
| Compound Name | 2-phenylmorpholin-4-amine;hydrochloride |
| PubChem CID | 54605145 |
| Molecular Formula | C10H15ClN2O |
| Molecular Weight | 214.70 g/mol |
| Exact Mass | 214.09 |
| IUPAC Name | 2-phenylmorpholin-4-amine;hydrochloride |
| SMILES | Cl.NN1CCOC(c2ccccc2)C1 |
| InChI | InChI=1S/C10H14N2O.ClH/c11-12-6-7-13-10(8-12)9-4-2-1-3-5-9;/h1-5,10H,6-8,11H2;1H |
| InChIKey | CEWDBPHXBFSREQ-UHFFFAOYSA-N |
| XLogP | 1.36 |
| TPSA | 38.49 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 214.70 |
| LogP ≤ 5 | 1.36 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'hydrazine', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 2-phenylmorpholin-4-amine;hydrochloride?
The IUPAC name of 2-phenylmorpholin-4-amine;hydrochloride (CID 54605145) is 2-phenylmorpholin-4-amine;hydrochloride.
What is the SMILES notation for 2-phenylmorpholin-4-amine;hydrochloride?
The canonical SMILES for 2-phenylmorpholin-4-amine;hydrochloride is Cl.NN1CCOC(c2ccccc2)C1.
What is the InChIKey of 2-phenylmorpholin-4-amine;hydrochloride?
The InChIKey is CEWDBPHXBFSREQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O.ClH/c11-12-6-7-13-10(8-12)9-4-2-1-3-5-9;/h1-5,10H,6-8,11H2;1H.
What are the key properties of 2-phenylmorpholin-4-amine;hydrochloride?
2-phenylmorpholin-4-amine;hydrochloride has a molecular weight of 214.70 g/mol, XLogP of 1.36, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenylmorpholin-4-amine;hydrochloride is sourced from PubChem (CID 54605145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).