About 1-cyclopropyl-1-[4-(2-methoxyethyl)phenyl]-N-methylmethanamine
1-cyclopropyl-1-[4-(2-methoxyethyl)phenyl]-N-methylmethanamine (PubChem CID 43482389) has the molecular formula C14H21NO
and a molecular weight of 219.33 g/mol. Its IUPAC name is 1-cyclopropyl-1-[4-(2-methoxyethyl)phenyl]-N-methylmethanamine.
Molecular Properties
| Compound Name | 1-cyclopropyl-1-[4-(2-methoxyethyl)phenyl]-N-methylmethanamine |
| PubChem CID | 43482389 |
| Molecular Formula | C14H21NO |
| Molecular Weight | 219.33 g/mol |
| Exact Mass | 219.16 |
| IUPAC Name | 1-cyclopropyl-1-[4-(2-methoxyethyl)phenyl]-N-methylmethanamine |
| SMILES | CNC(c1ccc(CCOC)cc1)C1CC1 |
| InChI | InChI=1S/C14H21NO/c1-15-14(13-7-8-13)12-5-3-11(4-6-12)9-10-16-2/h3-6,13-15H,7-10H2,1-2H3 |
| InChIKey | UTSWURQFAKYAKX-UHFFFAOYSA-N |
| XLogP | 2.55 |
| TPSA | 21.26 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 219.33 |
| LogP ≤ 5 | 2.55 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 1-cyclopropyl-1-[4-(2-methoxyethyl)phenyl]-N-methylmethanamine?
The IUPAC name of 1-cyclopropyl-1-[4-(2-methoxyethyl)phenyl]-N-methylmethanamine (CID 43482389) is 1-cyclopropyl-1-[4-(2-methoxyethyl)phenyl]-N-methylmethanamine.
What is the SMILES notation for 1-cyclopropyl-1-[4-(2-methoxyethyl)phenyl]-N-methylmethanamine?
The canonical SMILES for 1-cyclopropyl-1-[4-(2-methoxyethyl)phenyl]-N-methylmethanamine is CNC(c1ccc(CCOC)cc1)C1CC1.
What is the InChIKey of 1-cyclopropyl-1-[4-(2-methoxyethyl)phenyl]-N-methylmethanamine?
The InChIKey is UTSWURQFAKYAKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c1-15-14(13-7-8-13)12-5-3-11(4-6-12)9-10-16-2/h3-6,13-15H,7-10H2,1-2H3.
What are the key properties of 1-cyclopropyl-1-[4-(2-methoxyethyl)phenyl]-N-methylmethanamine?
1-cyclopropyl-1-[4-(2-methoxyethyl)phenyl]-N-methylmethanamine has a molecular weight of 219.33 g/mol, XLogP of 2.55, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-1-[4-(2-methoxyethyl)phenyl]-N-methylmethanamine is sourced from PubChem (CID 43482389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).