About (1R)-1-(4-cyclopentyloxyphenyl)-N-methylethanamine
(1R)-1-(4-cyclopentyloxyphenyl)-N-methylethanamine (PubChem CID 93007238) has the molecular formula C14H21NO
and a molecular weight of 219.33 g/mol. Its IUPAC name is (1R)-1-(4-cyclopentyloxyphenyl)-N-methylethanamine.
Molecular Properties
| Compound Name | (1R)-1-(4-cyclopentyloxyphenyl)-N-methylethanamine |
| PubChem CID | 93007238 |
| Molecular Formula | C14H21NO |
| Molecular Weight | 219.33 g/mol |
| Exact Mass | 219.16 |
| IUPAC Name | (1R)-1-(4-cyclopentyloxyphenyl)-N-methylethanamine |
| SMILES | CN[C@H](C)c1ccc(OC2CCCC2)cc1 |
| InChI | InChI=1S/C14H21NO/c1-11(15-2)12-7-9-14(10-8-12)16-13-5-3-4-6-13/h7-11,13,15H,3-6H2,1-2H3/t11-/m1/s1 |
| InChIKey | GGVKGNRLSYUVRQ-LLVKDONJSA-N |
| XLogP | 3.29 |
| TPSA | 21.26 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 219.33 |
| LogP ≤ 5 | 3.29 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of (1R)-1-(4-cyclopentyloxyphenyl)-N-methylethanamine?
The IUPAC name of (1R)-1-(4-cyclopentyloxyphenyl)-N-methylethanamine (CID 93007238) is (1R)-1-(4-cyclopentyloxyphenyl)-N-methylethanamine.
What is the SMILES notation for (1R)-1-(4-cyclopentyloxyphenyl)-N-methylethanamine?
The canonical SMILES for (1R)-1-(4-cyclopentyloxyphenyl)-N-methylethanamine is CN[C@H](C)c1ccc(OC2CCCC2)cc1.
What is the InChIKey of (1R)-1-(4-cyclopentyloxyphenyl)-N-methylethanamine?
The InChIKey is GGVKGNRLSYUVRQ-LLVKDONJSA-N. The full InChI is InChI=1S/C14H21NO/c1-11(15-2)12-7-9-14(10-8-12)16-13-5-3-4-6-13/h7-11,13,15H,3-6H2,1-2H3/t11-/m1/s1.
What are the key properties of (1R)-1-(4-cyclopentyloxyphenyl)-N-methylethanamine?
(1R)-1-(4-cyclopentyloxyphenyl)-N-methylethanamine has a molecular weight of 219.33 g/mol, XLogP of 3.29, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-(4-cyclopentyloxyphenyl)-N-methylethanamine is sourced from PubChem (CID 93007238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).