About N-[(2-phenylphenyl)methyl]-1-piperidin-4-ylmethanamine
N-[(2-phenylphenyl)methyl]-1-piperidin-4-ylmethanamine (PubChem CID 155181758) has the molecular formula C19H24N2
and a molecular weight of 280.42 g/mol. Its IUPAC name is N-[(2-phenylphenyl)methyl]-1-piperidin-4-ylmethanamine.
Molecular Properties
| Compound Name | N-[(2-phenylphenyl)methyl]-1-piperidin-4-ylmethanamine |
| PubChem CID | 155181758 |
| Molecular Formula | C19H24N2 |
| Molecular Weight | 280.42 g/mol |
| Exact Mass | 280.19 |
| IUPAC Name | N-[(2-phenylphenyl)methyl]-1-piperidin-4-ylmethanamine |
| SMILES | c1ccc(-c2ccccc2CNCC2CCNCC2)cc1 |
| InChI | InChI=1S/C19H24N2/c1-2-6-17(7-3-1)19-9-5-4-8-18(19)15-21-14-16-10-12-20-13-11-16/h1-9,16,20-21H,10-15H2 |
| InChIKey | FFXUXVHXQGNJAF-UHFFFAOYSA-N |
| XLogP | 3.44 |
| TPSA | 24.06 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 21 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 280.42 |
| LogP ≤ 5 | 3.44 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of N-[(2-phenylphenyl)methyl]-1-piperidin-4-ylmethanamine?
The IUPAC name of N-[(2-phenylphenyl)methyl]-1-piperidin-4-ylmethanamine (CID 155181758) is N-[(2-phenylphenyl)methyl]-1-piperidin-4-ylmethanamine.
What is the SMILES notation for N-[(2-phenylphenyl)methyl]-1-piperidin-4-ylmethanamine?
The canonical SMILES for N-[(2-phenylphenyl)methyl]-1-piperidin-4-ylmethanamine is c1ccc(-c2ccccc2CNCC2CCNCC2)cc1.
What is the InChIKey of N-[(2-phenylphenyl)methyl]-1-piperidin-4-ylmethanamine?
The InChIKey is FFXUXVHXQGNJAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2/c1-2-6-17(7-3-1)19-9-5-4-8-18(19)15-21-14-16-10-12-20-13-11-16/h1-9,16,20-21H,10-15H2.
What are the key properties of N-[(2-phenylphenyl)methyl]-1-piperidin-4-ylmethanamine?
N-[(2-phenylphenyl)methyl]-1-piperidin-4-ylmethanamine has a molecular weight of 280.42 g/mol, XLogP of 3.44, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-phenylphenyl)methyl]-1-piperidin-4-ylmethanamine is sourced from PubChem (CID 155181758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).