About (1R)-N-ethyl-1-(2-methoxyphenyl)-N-methylethanamine
(1R)-N-ethyl-1-(2-methoxyphenyl)-N-methylethanamine (PubChem CID 118327627) has the molecular formula C12H19NO
and a molecular weight of 193.29 g/mol. Its IUPAC name is (1R)-N-ethyl-1-(2-methoxyphenyl)-N-methylethanamine.
Molecular Properties
| Compound Name | (1R)-N-ethyl-1-(2-methoxyphenyl)-N-methylethanamine |
| PubChem CID | 118327627 |
| Molecular Formula | C12H19NO |
| Molecular Weight | 193.29 g/mol |
| Exact Mass | 193.15 |
| IUPAC Name | (1R)-N-ethyl-1-(2-methoxyphenyl)-N-methylethanamine |
| SMILES | CCN(C)[C@H](C)c1ccccc1OC |
| InChI | InChI=1S/C12H19NO/c1-5-13(3)10(2)11-8-6-7-9-12(11)14-4/h6-10H,5H2,1-4H3/t10-/m1/s1 |
| InChIKey | HSGCIYFJKZEQGV-SNVBAGLBSA-N |
| XLogP | 2.71 |
| TPSA | 12.47 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 193.29 |
| LogP ≤ 5 | 2.71 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of (1R)-N-ethyl-1-(2-methoxyphenyl)-N-methylethanamine?
The IUPAC name of (1R)-N-ethyl-1-(2-methoxyphenyl)-N-methylethanamine (CID 118327627) is (1R)-N-ethyl-1-(2-methoxyphenyl)-N-methylethanamine.
What is the SMILES notation for (1R)-N-ethyl-1-(2-methoxyphenyl)-N-methylethanamine?
The canonical SMILES for (1R)-N-ethyl-1-(2-methoxyphenyl)-N-methylethanamine is CCN(C)[C@H](C)c1ccccc1OC.
What is the InChIKey of (1R)-N-ethyl-1-(2-methoxyphenyl)-N-methylethanamine?
The InChIKey is HSGCIYFJKZEQGV-SNVBAGLBSA-N. The full InChI is InChI=1S/C12H19NO/c1-5-13(3)10(2)11-8-6-7-9-12(11)14-4/h6-10H,5H2,1-4H3/t10-/m1/s1.
What are the key properties of (1R)-N-ethyl-1-(2-methoxyphenyl)-N-methylethanamine?
(1R)-N-ethyl-1-(2-methoxyphenyl)-N-methylethanamine has a molecular weight of 193.29 g/mol, XLogP of 2.71, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-N-ethyl-1-(2-methoxyphenyl)-N-methylethanamine is sourced from PubChem (CID 118327627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).