About N-methyl-2-piperidin-4-ylpropan-1-amine
N-methyl-2-piperidin-4-ylpropan-1-amine (PubChem CID 84650476) has the molecular formula C9H20N2
and a molecular weight of 156.27 g/mol. Its IUPAC name is N-methyl-2-piperidin-4-ylpropan-1-amine.
Molecular Properties
| Compound Name | N-methyl-2-piperidin-4-ylpropan-1-amine |
| PubChem CID | 84650476 |
| Molecular Formula | C9H20N2 |
| Molecular Weight | 156.27 g/mol |
| Exact Mass | 156.16 |
| IUPAC Name | N-methyl-2-piperidin-4-ylpropan-1-amine |
| SMILES | CNCC(C)C1CCNCC1 |
| InChI | InChI=1S/C9H20N2/c1-8(7-10-2)9-3-5-11-6-4-9/h8-11H,3-7H2,1-2H3 |
| InChIKey | WEIQLZAUHRDVSI-UHFFFAOYSA-N |
| XLogP | 0.84 |
| TPSA | 24.06 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 11 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 156.27 |
| LogP ≤ 5 | 0.84 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of N-methyl-2-piperidin-4-ylpropan-1-amine?
The IUPAC name of N-methyl-2-piperidin-4-ylpropan-1-amine (CID 84650476) is N-methyl-2-piperidin-4-ylpropan-1-amine.
What is the SMILES notation for N-methyl-2-piperidin-4-ylpropan-1-amine?
The canonical SMILES for N-methyl-2-piperidin-4-ylpropan-1-amine is CNCC(C)C1CCNCC1.
What is the InChIKey of N-methyl-2-piperidin-4-ylpropan-1-amine?
The InChIKey is WEIQLZAUHRDVSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2/c1-8(7-10-2)9-3-5-11-6-4-9/h8-11H,3-7H2,1-2H3.
What are the key properties of N-methyl-2-piperidin-4-ylpropan-1-amine?
N-methyl-2-piperidin-4-ylpropan-1-amine has a molecular weight of 156.27 g/mol, XLogP of 0.84, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-piperidin-4-ylpropan-1-amine is sourced from PubChem (CID 84650476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).