About 2-[6-(3-methylphenyl)-3-pyridinyl]ethanol
2-[6-(3-methylphenyl)-3-pyridinyl]ethanol (PubChem CID 117001661) has the molecular formula C14H15NO
and a molecular weight of 213.28 g/mol. Its IUPAC name is 2-[6-(3-methylphenyl)-3-pyridinyl]ethanol.
Molecular Properties
| Compound Name | 2-[6-(3-methylphenyl)-3-pyridinyl]ethanol |
| PubChem CID | 117001661 |
| Molecular Formula | C14H15NO |
| Molecular Weight | 213.28 g/mol |
| Exact Mass | 213.12 |
| IUPAC Name | 2-[6-(3-methylphenyl)-3-pyridinyl]ethanol |
| SMILES | Cc1cccc(-c2ccc(CCO)cn2)c1 |
| InChI | InChI=1S/C14H15NO/c1-11-3-2-4-13(9-11)14-6-5-12(7-8-16)10-15-14/h2-6,9-10,16H,7-8H2,1H3 |
| InChIKey | MWYNGJVQUXYNDF-UHFFFAOYSA-N |
| XLogP | 2.59 |
| TPSA | 33.12 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 213.28 |
| LogP ≤ 5 | 2.59 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 2-[6-(3-methylphenyl)-3-pyridinyl]ethanol?
The IUPAC name of 2-[6-(3-methylphenyl)-3-pyridinyl]ethanol (CID 117001661) is 2-[6-(3-methylphenyl)-3-pyridinyl]ethanol.
What is the SMILES notation for 2-[6-(3-methylphenyl)-3-pyridinyl]ethanol?
The canonical SMILES for 2-[6-(3-methylphenyl)-3-pyridinyl]ethanol is Cc1cccc(-c2ccc(CCO)cn2)c1.
What is the InChIKey of 2-[6-(3-methylphenyl)-3-pyridinyl]ethanol?
The InChIKey is MWYNGJVQUXYNDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO/c1-11-3-2-4-13(9-11)14-6-5-12(7-8-16)10-15-14/h2-6,9-10,16H,7-8H2,1H3.
What are the key properties of 2-[6-(3-methylphenyl)-3-pyridinyl]ethanol?
2-[6-(3-methylphenyl)-3-pyridinyl]ethanol has a molecular weight of 213.28 g/mol, XLogP of 2.59, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-(3-methylphenyl)-3-pyridinyl]ethanol is sourced from PubChem (CID 117001661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).