About 1-cyclopentyl-1-(4-ethylphenyl)-N-methylmethanamine
1-cyclopentyl-1-(4-ethylphenyl)-N-methylmethanamine (PubChem CID 43484724) has the molecular formula C15H23N
and a molecular weight of 217.36 g/mol. Its IUPAC name is 1-cyclopentyl-1-(4-ethylphenyl)-N-methylmethanamine.
Molecular Properties
| Compound Name | 1-cyclopentyl-1-(4-ethylphenyl)-N-methylmethanamine |
| PubChem CID | 43484724 |
| Molecular Formula | C15H23N |
| Molecular Weight | 217.36 g/mol |
| Exact Mass | 217.18 |
| IUPAC Name | 1-cyclopentyl-1-(4-ethylphenyl)-N-methylmethanamine |
| SMILES | CCc1ccc(C(NC)C2CCCC2)cc1 |
| InChI | InChI=1S/C15H23N/c1-3-12-8-10-14(11-9-12)15(16-2)13-6-4-5-7-13/h8-11,13,15-16H,3-7H2,1-2H3 |
| InChIKey | AOTBUTPESCPVSP-UHFFFAOYSA-N |
| XLogP | 3.70 |
| TPSA | 12.03 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 217.36 |
| LogP ≤ 5 | 3.70 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 1 |
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Frequently Asked Questions
What is the IUPAC name of 1-cyclopentyl-1-(4-ethylphenyl)-N-methylmethanamine?
The IUPAC name of 1-cyclopentyl-1-(4-ethylphenyl)-N-methylmethanamine (CID 43484724) is 1-cyclopentyl-1-(4-ethylphenyl)-N-methylmethanamine.
What is the SMILES notation for 1-cyclopentyl-1-(4-ethylphenyl)-N-methylmethanamine?
The canonical SMILES for 1-cyclopentyl-1-(4-ethylphenyl)-N-methylmethanamine is CCc1ccc(C(NC)C2CCCC2)cc1.
What is the InChIKey of 1-cyclopentyl-1-(4-ethylphenyl)-N-methylmethanamine?
The InChIKey is AOTBUTPESCPVSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N/c1-3-12-8-10-14(11-9-12)15(16-2)13-6-4-5-7-13/h8-11,13,15-16H,3-7H2,1-2H3.
What are the key properties of 1-cyclopentyl-1-(4-ethylphenyl)-N-methylmethanamine?
1-cyclopentyl-1-(4-ethylphenyl)-N-methylmethanamine has a molecular weight of 217.36 g/mol, XLogP of 3.70, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-1-(4-ethylphenyl)-N-methylmethanamine is sourced from PubChem (CID 43484724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).