About [2-[methyl(2-phenylethyl)amino]-3-pyridinyl]methanol
[2-[methyl(2-phenylethyl)amino]-3-pyridinyl]methanol (PubChem CID 65488591) has the molecular formula C15H18N2O
and a molecular weight of 242.32 g/mol. Its IUPAC name is [2-[methyl(2-phenylethyl)amino]-3-pyridinyl]methanol.
Molecular Properties
| Compound Name | [2-[methyl(2-phenylethyl)amino]-3-pyridinyl]methanol |
| PubChem CID | 65488591 |
| Molecular Formula | C15H18N2O |
| Molecular Weight | 242.32 g/mol |
| Exact Mass | 242.14 |
| IUPAC Name | [2-[methyl(2-phenylethyl)amino]-3-pyridinyl]methanol |
| SMILES | CN(CCc1ccccc1)c1ncccc1CO |
| InChI | InChI=1S/C15H18N2O/c1-17(11-9-13-6-3-2-4-7-13)15-14(12-18)8-5-10-16-15/h2-8,10,18H,9,11-12H2,1H3 |
| InChIKey | BVCZUIQKMVZRRQ-UHFFFAOYSA-N |
| XLogP | 2.25 |
| TPSA | 36.36 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 242.32 |
| LogP ≤ 5 | 2.25 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of [2-[methyl(2-phenylethyl)amino]-3-pyridinyl]methanol?
The IUPAC name of [2-[methyl(2-phenylethyl)amino]-3-pyridinyl]methanol (CID 65488591) is [2-[methyl(2-phenylethyl)amino]-3-pyridinyl]methanol.
What is the SMILES notation for [2-[methyl(2-phenylethyl)amino]-3-pyridinyl]methanol?
The canonical SMILES for [2-[methyl(2-phenylethyl)amino]-3-pyridinyl]methanol is CN(CCc1ccccc1)c1ncccc1CO.
What is the InChIKey of [2-[methyl(2-phenylethyl)amino]-3-pyridinyl]methanol?
The InChIKey is BVCZUIQKMVZRRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O/c1-17(11-9-13-6-3-2-4-7-13)15-14(12-18)8-5-10-16-15/h2-8,10,18H,9,11-12H2,1H3.
What are the key properties of [2-[methyl(2-phenylethyl)amino]-3-pyridinyl]methanol?
[2-[methyl(2-phenylethyl)amino]-3-pyridinyl]methanol has a molecular weight of 242.32 g/mol, XLogP of 2.25, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[methyl(2-phenylethyl)amino]-3-pyridinyl]methanol is sourced from PubChem (CID 65488591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).