About 3-cyclopentyl-1-(5-methoxy-3-pyridinyl)-N-methylpropan-1-amine
3-cyclopentyl-1-(5-methoxy-3-pyridinyl)-N-methylpropan-1-amine (PubChem CID 105025992) has the molecular formula C15H24N2O
and a molecular weight of 248.37 g/mol. Its IUPAC name is 3-cyclopentyl-1-(5-methoxy-3-pyridinyl)-N-methylpropan-1-amine.
Molecular Properties
| Compound Name | 3-cyclopentyl-1-(5-methoxy-3-pyridinyl)-N-methylpropan-1-amine |
| PubChem CID | 105025992 |
| Molecular Formula | C15H24N2O |
| Molecular Weight | 248.37 g/mol |
| Exact Mass | 248.19 |
| IUPAC Name | 3-cyclopentyl-1-(5-methoxy-3-pyridinyl)-N-methylpropan-1-amine |
| SMILES | CNC(CCC1CCCC1)c1cncc(OC)c1 |
| InChI | InChI=1S/C15H24N2O/c1-16-15(8-7-12-5-3-4-6-12)13-9-14(18-2)11-17-10-13/h9-12,15-16H,3-8H2,1-2H3 |
| InChIKey | QSMADIIWSHUGCL-UHFFFAOYSA-N |
| XLogP | 3.32 |
| TPSA | 34.15 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 248.37 |
| LogP ≤ 5 | 3.32 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 3-cyclopentyl-1-(5-methoxy-3-pyridinyl)-N-methylpropan-1-amine?
The IUPAC name of 3-cyclopentyl-1-(5-methoxy-3-pyridinyl)-N-methylpropan-1-amine (CID 105025992) is 3-cyclopentyl-1-(5-methoxy-3-pyridinyl)-N-methylpropan-1-amine.
What is the SMILES notation for 3-cyclopentyl-1-(5-methoxy-3-pyridinyl)-N-methylpropan-1-amine?
The canonical SMILES for 3-cyclopentyl-1-(5-methoxy-3-pyridinyl)-N-methylpropan-1-amine is CNC(CCC1CCCC1)c1cncc(OC)c1.
What is the InChIKey of 3-cyclopentyl-1-(5-methoxy-3-pyridinyl)-N-methylpropan-1-amine?
The InChIKey is QSMADIIWSHUGCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-16-15(8-7-12-5-3-4-6-12)13-9-14(18-2)11-17-10-13/h9-12,15-16H,3-8H2,1-2H3.
What are the key properties of 3-cyclopentyl-1-(5-methoxy-3-pyridinyl)-N-methylpropan-1-amine?
3-cyclopentyl-1-(5-methoxy-3-pyridinyl)-N-methylpropan-1-amine has a molecular weight of 248.37 g/mol, XLogP of 3.32, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopentyl-1-(5-methoxy-3-pyridinyl)-N-methylpropan-1-amine is sourced from PubChem (CID 105025992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).