About (1S)-1-[6-(dimethylamino)-2-methyl-3-pyridinyl]ethanol
(1S)-1-[6-(dimethylamino)-2-methyl-3-pyridinyl]ethanol (PubChem CID 124502267) has the molecular formula C10H16N2O
and a molecular weight of 180.25 g/mol. Its IUPAC name is (1S)-1-[6-(dimethylamino)-2-methyl-3-pyridinyl]ethanol.
Molecular Properties
| Compound Name | (1S)-1-[6-(dimethylamino)-2-methyl-3-pyridinyl]ethanol |
| PubChem CID | 124502267 |
| Molecular Formula | C10H16N2O |
| Molecular Weight | 180.25 g/mol |
| Exact Mass | 180.13 |
| IUPAC Name | (1S)-1-[6-(dimethylamino)-2-methyl-3-pyridinyl]ethanol |
| SMILES | Cc1nc(N(C)C)ccc1[C@H](C)O |
| InChI | InChI=1S/C10H16N2O/c1-7-9(8(2)13)5-6-10(11-7)12(3)4/h5-6,8,13H,1-4H3/t8-/m0/s1 |
| InChIKey | ZTERPHHAUYDNSE-QMMMGPOBSA-N |
| XLogP | 1.51 |
| TPSA | 36.36 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 13 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 180.25 |
| LogP ≤ 5 | 1.51 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of (1S)-1-[6-(dimethylamino)-2-methyl-3-pyridinyl]ethanol?
The IUPAC name of (1S)-1-[6-(dimethylamino)-2-methyl-3-pyridinyl]ethanol (CID 124502267) is (1S)-1-[6-(dimethylamino)-2-methyl-3-pyridinyl]ethanol.
What is the SMILES notation for (1S)-1-[6-(dimethylamino)-2-methyl-3-pyridinyl]ethanol?
The canonical SMILES for (1S)-1-[6-(dimethylamino)-2-methyl-3-pyridinyl]ethanol is Cc1nc(N(C)C)ccc1[C@H](C)O.
What is the InChIKey of (1S)-1-[6-(dimethylamino)-2-methyl-3-pyridinyl]ethanol?
The InChIKey is ZTERPHHAUYDNSE-QMMMGPOBSA-N. The full InChI is InChI=1S/C10H16N2O/c1-7-9(8(2)13)5-6-10(11-7)12(3)4/h5-6,8,13H,1-4H3/t8-/m0/s1.
What are the key properties of (1S)-1-[6-(dimethylamino)-2-methyl-3-pyridinyl]ethanol?
(1S)-1-[6-(dimethylamino)-2-methyl-3-pyridinyl]ethanol has a molecular weight of 180.25 g/mol, XLogP of 1.51, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-1-[6-(dimethylamino)-2-methyl-3-pyridinyl]ethanol is sourced from PubChem (CID 124502267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).