About N-methyl-2-phenylpropan-1-amine
N-methyl-2-phenylpropan-1-amine (PubChem CID 22276) has the molecular formula C10H15N
and a molecular weight of 149.24 g/mol. Its IUPAC name is N-methyl-2-phenylpropan-1-amine.
Molecular Properties
| Compound Name | N-methyl-2-phenylpropan-1-amine |
| PubChem CID | 22276 |
| Molecular Formula | C10H15N |
| Molecular Weight | 149.24 g/mol |
| Exact Mass | 149.12 |
| IUPAC Name | N-methyl-2-phenylpropan-1-amine |
| SMILES | CNCC(C)c1ccccc1 |
| InChI | InChI=1S/C10H15N/c1-9(8-11-2)10-6-4-3-5-7-10/h3-7,9,11H,8H2,1-2H3 |
| InChIKey | AUFSOOYCQYDGES-UHFFFAOYSA-N |
| XLogP | 2.01 |
| TPSA | 12.03 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 11 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 149.24 |
| LogP ≤ 5 | 2.01 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 1 |
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Frequently Asked Questions
What is the IUPAC name of N-methyl-2-phenylpropan-1-amine?
The IUPAC name of N-methyl-2-phenylpropan-1-amine (CID 22276) is N-methyl-2-phenylpropan-1-amine.
What is the SMILES notation for N-methyl-2-phenylpropan-1-amine?
The canonical SMILES for N-methyl-2-phenylpropan-1-amine is CNCC(C)c1ccccc1.
What is the InChIKey of N-methyl-2-phenylpropan-1-amine?
The InChIKey is AUFSOOYCQYDGES-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N/c1-9(8-11-2)10-6-4-3-5-7-10/h3-7,9,11H,8H2,1-2H3.
What are the key properties of N-methyl-2-phenylpropan-1-amine?
N-methyl-2-phenylpropan-1-amine has a molecular weight of 149.24 g/mol, XLogP of 2.01, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-phenylpropan-1-amine is sourced from PubChem (CID 22276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).