About 1-(1-cyclopentylpropyl)imidazole
1-(1-cyclopentylpropyl)imidazole (PubChem CID 174543958) has the molecular formula C11H18N2
and a molecular weight of 178.28 g/mol. Its IUPAC name is 1-(1-cyclopentylpropyl)imidazole.
Molecular Properties
| Compound Name | 1-(1-cyclopentylpropyl)imidazole |
| PubChem CID | 174543958 |
| Molecular Formula | C11H18N2 |
| Molecular Weight | 178.28 g/mol |
| Exact Mass | 178.15 |
| IUPAC Name | 1-(1-cyclopentylpropyl)imidazole |
| SMILES | CCC(C1CCCC1)n1ccnc1 |
| InChI | InChI=1S/C11H18N2/c1-2-11(10-5-3-4-6-10)13-8-7-12-9-13/h7-11H,2-6H2,1H3 |
| InChIKey | NIVFRHUWJWAOFD-UHFFFAOYSA-N |
| XLogP | 3.02 |
| TPSA | 17.82 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 13 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 178.28 |
| LogP ≤ 5 | 3.02 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 1-(1-cyclopentylpropyl)imidazole?
The IUPAC name of 1-(1-cyclopentylpropyl)imidazole (CID 174543958) is 1-(1-cyclopentylpropyl)imidazole.
What is the SMILES notation for 1-(1-cyclopentylpropyl)imidazole?
The canonical SMILES for 1-(1-cyclopentylpropyl)imidazole is CCC(C1CCCC1)n1ccnc1.
What is the InChIKey of 1-(1-cyclopentylpropyl)imidazole?
The InChIKey is NIVFRHUWJWAOFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2/c1-2-11(10-5-3-4-6-10)13-8-7-12-9-13/h7-11H,2-6H2,1H3.
What are the key properties of 1-(1-cyclopentylpropyl)imidazole?
1-(1-cyclopentylpropyl)imidazole has a molecular weight of 178.28 g/mol, XLogP of 3.02, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-cyclopentylpropyl)imidazole is sourced from PubChem (CID 174543958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).