About [4-[(2-phenylmorpholin-4-yl)methyl]phenyl]methanol
[4-[(2-phenylmorpholin-4-yl)methyl]phenyl]methanol (PubChem CID 110008119) has the molecular formula C18H21NO2
and a molecular weight of 283.37 g/mol. Its IUPAC name is [4-[(2-phenylmorpholin-4-yl)methyl]phenyl]methanol.
Molecular Properties
| Compound Name | [4-[(2-phenylmorpholin-4-yl)methyl]phenyl]methanol |
| PubChem CID | 110008119 |
| Molecular Formula | C18H21NO2 |
| Molecular Weight | 283.37 g/mol |
| Exact Mass | 283.16 |
| IUPAC Name | [4-[(2-phenylmorpholin-4-yl)methyl]phenyl]methanol |
| SMILES | OCc1ccc(CN2CCOC(c3ccccc3)C2)cc1 |
| InChI | InChI=1S/C18H21NO2/c20-14-16-8-6-15(7-9-16)12-19-10-11-21-18(13-19)17-4-2-1-3-5-17/h1-9,18,20H,10-14H2 |
| InChIKey | ATIVYBSQSKKDDW-UHFFFAOYSA-N |
| XLogP | 2.75 |
| TPSA | 32.70 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 21 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 283.37 |
| LogP ≤ 5 | 2.75 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of [4-[(2-phenylmorpholin-4-yl)methyl]phenyl]methanol?
The IUPAC name of [4-[(2-phenylmorpholin-4-yl)methyl]phenyl]methanol (CID 110008119) is [4-[(2-phenylmorpholin-4-yl)methyl]phenyl]methanol.
What is the SMILES notation for [4-[(2-phenylmorpholin-4-yl)methyl]phenyl]methanol?
The canonical SMILES for [4-[(2-phenylmorpholin-4-yl)methyl]phenyl]methanol is OCc1ccc(CN2CCOC(c3ccccc3)C2)cc1.
What is the InChIKey of [4-[(2-phenylmorpholin-4-yl)methyl]phenyl]methanol?
The InChIKey is ATIVYBSQSKKDDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO2/c20-14-16-8-6-15(7-9-16)12-19-10-11-21-18(13-19)17-4-2-1-3-5-17/h1-9,18,20H,10-14H2.
What are the key properties of [4-[(2-phenylmorpholin-4-yl)methyl]phenyl]methanol?
[4-[(2-phenylmorpholin-4-yl)methyl]phenyl]methanol has a molecular weight of 283.37 g/mol, XLogP of 2.75, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[(2-phenylmorpholin-4-yl)methyl]phenyl]methanol is sourced from PubChem (CID 110008119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).