About 2-phenyl-2-(3-phenylpropyl)pyrrolidine
2-phenyl-2-(3-phenylpropyl)pyrrolidine (PubChem CID 167199912) has the molecular formula C19H23N
and a molecular weight of 265.40 g/mol. Its IUPAC name is 2-phenyl-2-(3-phenylpropyl)pyrrolidine.
Molecular Properties
| Compound Name | 2-phenyl-2-(3-phenylpropyl)pyrrolidine |
| PubChem CID | 167199912 |
| Molecular Formula | C19H23N |
| Molecular Weight | 265.40 g/mol |
| Exact Mass | 265.18 |
| IUPAC Name | 2-phenyl-2-(3-phenylpropyl)pyrrolidine |
| SMILES | c1ccc(CCCC2(c3ccccc3)CCCN2)cc1 |
| InChI | InChI=1S/C19H23N/c1-3-9-17(10-4-1)11-7-14-19(15-8-16-20-19)18-12-5-2-6-13-18/h1-6,9-10,12-13,20H,7-8,11,14-16H2 |
| InChIKey | ZADMFVUVUKXUTB-UHFFFAOYSA-N |
| XLogP | 4.29 |
| TPSA | 12.03 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 20 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 265.40 |
| LogP ≤ 5 | 4.29 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 1 |
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Frequently Asked Questions
What is the IUPAC name of 2-phenyl-2-(3-phenylpropyl)pyrrolidine?
The IUPAC name of 2-phenyl-2-(3-phenylpropyl)pyrrolidine (CID 167199912) is 2-phenyl-2-(3-phenylpropyl)pyrrolidine.
What is the SMILES notation for 2-phenyl-2-(3-phenylpropyl)pyrrolidine?
The canonical SMILES for 2-phenyl-2-(3-phenylpropyl)pyrrolidine is c1ccc(CCCC2(c3ccccc3)CCCN2)cc1.
What is the InChIKey of 2-phenyl-2-(3-phenylpropyl)pyrrolidine?
The InChIKey is ZADMFVUVUKXUTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N/c1-3-9-17(10-4-1)11-7-14-19(15-8-16-20-19)18-12-5-2-6-13-18/h1-6,9-10,12-13,20H,7-8,11,14-16H2.
What are the key properties of 2-phenyl-2-(3-phenylpropyl)pyrrolidine?
2-phenyl-2-(3-phenylpropyl)pyrrolidine has a molecular weight of 265.40 g/mol, XLogP of 4.29, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-2-(3-phenylpropyl)pyrrolidine is sourced from PubChem (CID 167199912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).