About 1-[2-[dimethylamino(phenyl)methyl]phenyl]-N,N-dimethyl-1-phenylmethanamine
1-[2-[dimethylamino(phenyl)methyl]phenyl]-N,N-dimethyl-1-phenylmethanamine (PubChem CID 139888809) has the molecular formula C24H28N2
and a molecular weight of 344.50 g/mol. Its IUPAC name is 1-[2-[dimethylamino(phenyl)methyl]phenyl]-N,N-dimethyl-1-phenylmethanamine.
Molecular Properties
| Compound Name | 1-[2-[dimethylamino(phenyl)methyl]phenyl]-N,N-dimethyl-1-phenylmethanamine |
| PubChem CID | 139888809 |
| Molecular Formula | C24H28N2 |
| Molecular Weight | 344.50 g/mol |
| Exact Mass | 344.23 |
| IUPAC Name | 1-[2-[dimethylamino(phenyl)methyl]phenyl]-N,N-dimethyl-1-phenylmethanamine |
| SMILES | CN(C)C(c1ccccc1)c1ccccc1C(c1ccccc1)N(C)C |
| InChI | InChI=1S/C24H28N2/c1-25(2)23(19-13-7-5-8-14-19)21-17-11-12-18-22(21)24(26(3)4)20-15-9-6-10-16-20/h5-18,23-24H,1-4H3 |
| InChIKey | UDFMNDVHRZWBQN-UHFFFAOYSA-N |
| XLogP | 4.99 |
| TPSA | 6.48 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 26 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 344.50 |
| LogP ≤ 5 | 4.99 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 1-[2-[dimethylamino(phenyl)methyl]phenyl]-N,N-dimethyl-1-phenylmethanamine?
The IUPAC name of 1-[2-[dimethylamino(phenyl)methyl]phenyl]-N,N-dimethyl-1-phenylmethanamine (CID 139888809) is 1-[2-[dimethylamino(phenyl)methyl]phenyl]-N,N-dimethyl-1-phenylmethanamine.
What is the SMILES notation for 1-[2-[dimethylamino(phenyl)methyl]phenyl]-N,N-dimethyl-1-phenylmethanamine?
The canonical SMILES for 1-[2-[dimethylamino(phenyl)methyl]phenyl]-N,N-dimethyl-1-phenylmethanamine is CN(C)C(c1ccccc1)c1ccccc1C(c1ccccc1)N(C)C.
What is the InChIKey of 1-[2-[dimethylamino(phenyl)methyl]phenyl]-N,N-dimethyl-1-phenylmethanamine?
The InChIKey is UDFMNDVHRZWBQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28N2/c1-25(2)23(19-13-7-5-8-14-19)21-17-11-12-18-22(21)24(26(3)4)20-15-9-6-10-16-20/h5-18,23-24H,1-4H3.
What are the key properties of 1-[2-[dimethylamino(phenyl)methyl]phenyl]-N,N-dimethyl-1-phenylmethanamine?
1-[2-[dimethylamino(phenyl)methyl]phenyl]-N,N-dimethyl-1-phenylmethanamine has a molecular weight of 344.50 g/mol, XLogP of 4.99, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[dimethylamino(phenyl)methyl]phenyl]-N,N-dimethyl-1-phenylmethanamine is sourced from PubChem (CID 139888809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).