About 1-(2-benzyl-2-phenylcyclopropyl)pyrrolidine
1-(2-benzyl-2-phenylcyclopropyl)pyrrolidine (PubChem CID 173232892) has the molecular formula C20H23N
and a molecular weight of 277.41 g/mol. Its IUPAC name is 1-(2-benzyl-2-phenylcyclopropyl)pyrrolidine.
Molecular Properties
| Compound Name | 1-(2-benzyl-2-phenylcyclopropyl)pyrrolidine |
| PubChem CID | 173232892 |
| Molecular Formula | C20H23N |
| Molecular Weight | 277.41 g/mol |
| Exact Mass | 277.18 |
| IUPAC Name | 1-(2-benzyl-2-phenylcyclopropyl)pyrrolidine |
| SMILES | c1ccc(CC2(c3ccccc3)CC2N2CCCC2)cc1 |
| InChI | InChI=1S/C20H23N/c1-3-9-17(10-4-1)15-20(18-11-5-2-6-12-18)16-19(20)21-13-7-8-14-21/h1-6,9-12,19H,7-8,13-16H2 |
| InChIKey | ZPRXIADNVPYJHY-UHFFFAOYSA-N |
| XLogP | 4.04 |
| TPSA | 3.24 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 21 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 277.41 |
| LogP ≤ 5 | 4.04 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 1 |
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Frequently Asked Questions
What is the IUPAC name of 1-(2-benzyl-2-phenylcyclopropyl)pyrrolidine?
The IUPAC name of 1-(2-benzyl-2-phenylcyclopropyl)pyrrolidine (CID 173232892) is 1-(2-benzyl-2-phenylcyclopropyl)pyrrolidine.
What is the SMILES notation for 1-(2-benzyl-2-phenylcyclopropyl)pyrrolidine?
The canonical SMILES for 1-(2-benzyl-2-phenylcyclopropyl)pyrrolidine is c1ccc(CC2(c3ccccc3)CC2N2CCCC2)cc1.
What is the InChIKey of 1-(2-benzyl-2-phenylcyclopropyl)pyrrolidine?
The InChIKey is ZPRXIADNVPYJHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N/c1-3-9-17(10-4-1)15-20(18-11-5-2-6-12-18)16-19(20)21-13-7-8-14-21/h1-6,9-12,19H,7-8,13-16H2.
What are the key properties of 1-(2-benzyl-2-phenylcyclopropyl)pyrrolidine?
1-(2-benzyl-2-phenylcyclopropyl)pyrrolidine has a molecular weight of 277.41 g/mol, XLogP of 4.04, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-benzyl-2-phenylcyclopropyl)pyrrolidine is sourced from PubChem (CID 173232892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).