About 1-(3-cyclopentyl-2-methylcyclopentyl)ethanamine
1-(3-cyclopentyl-2-methylcyclopentyl)ethanamine (PubChem CID 90963271) has the molecular formula C13H25N
and a molecular weight of 195.35 g/mol. Its IUPAC name is 1-(3-cyclopentyl-2-methylcyclopentyl)ethanamine.
Molecular Properties
| Compound Name | 1-(3-cyclopentyl-2-methylcyclopentyl)ethanamine |
| PubChem CID | 90963271 |
| Molecular Formula | C13H25N |
| Molecular Weight | 195.35 g/mol |
| Exact Mass | 195.20 |
| IUPAC Name | 1-(3-cyclopentyl-2-methylcyclopentyl)ethanamine |
| SMILES | CC(N)C1CCC(C2CCCC2)C1C |
| InChI | InChI=1S/C13H25N/c1-9-12(10(2)14)7-8-13(9)11-5-3-4-6-11/h9-13H,3-8,14H2,1-2H3 |
| InChIKey | LRGVHVAFCNWVSF-UHFFFAOYSA-N |
| XLogP | 3.19 |
| TPSA | 26.02 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 195.35 |
| LogP ≤ 5 | 3.19 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 1 |
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Frequently Asked Questions
What is the IUPAC name of 1-(3-cyclopentyl-2-methylcyclopentyl)ethanamine?
The IUPAC name of 1-(3-cyclopentyl-2-methylcyclopentyl)ethanamine (CID 90963271) is 1-(3-cyclopentyl-2-methylcyclopentyl)ethanamine.
What is the SMILES notation for 1-(3-cyclopentyl-2-methylcyclopentyl)ethanamine?
The canonical SMILES for 1-(3-cyclopentyl-2-methylcyclopentyl)ethanamine is CC(N)C1CCC(C2CCCC2)C1C.
What is the InChIKey of 1-(3-cyclopentyl-2-methylcyclopentyl)ethanamine?
The InChIKey is LRGVHVAFCNWVSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N/c1-9-12(10(2)14)7-8-13(9)11-5-3-4-6-11/h9-13H,3-8,14H2,1-2H3.
What are the key properties of 1-(3-cyclopentyl-2-methylcyclopentyl)ethanamine?
1-(3-cyclopentyl-2-methylcyclopentyl)ethanamine has a molecular weight of 195.35 g/mol, XLogP of 3.19, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-cyclopentyl-2-methylcyclopentyl)ethanamine is sourced from PubChem (CID 90963271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).