About 4-methyl-1-(1-methylcyclopentyl)-N-propylpentan-1-amine
4-methyl-1-(1-methylcyclopentyl)-N-propylpentan-1-amine (PubChem CID 115834516) has the molecular formula C15H31N
and a molecular weight of 225.42 g/mol. Its IUPAC name is 4-methyl-1-(1-methylcyclopentyl)-N-propylpentan-1-amine.
Molecular Properties
| Compound Name | 4-methyl-1-(1-methylcyclopentyl)-N-propylpentan-1-amine |
| PubChem CID | 115834516 |
| Molecular Formula | C15H31N |
| Molecular Weight | 225.42 g/mol |
| Exact Mass | 225.25 |
| IUPAC Name | 4-methyl-1-(1-methylcyclopentyl)-N-propylpentan-1-amine |
| SMILES | CCCNC(CCC(C)C)C1(C)CCCC1 |
| InChI | InChI=1S/C15H31N/c1-5-12-16-14(9-8-13(2)3)15(4)10-6-7-11-15/h13-14,16H,5-12H2,1-4H3 |
| InChIKey | LUUXBMODWNQBSV-UHFFFAOYSA-N |
| XLogP | 4.37 |
| TPSA | 12.03 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 7 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 225.42 |
| LogP ≤ 5 | 4.37 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 1 |
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Frequently Asked Questions
What is the IUPAC name of 4-methyl-1-(1-methylcyclopentyl)-N-propylpentan-1-amine?
The IUPAC name of 4-methyl-1-(1-methylcyclopentyl)-N-propylpentan-1-amine (CID 115834516) is 4-methyl-1-(1-methylcyclopentyl)-N-propylpentan-1-amine.
What is the SMILES notation for 4-methyl-1-(1-methylcyclopentyl)-N-propylpentan-1-amine?
The canonical SMILES for 4-methyl-1-(1-methylcyclopentyl)-N-propylpentan-1-amine is CCCNC(CCC(C)C)C1(C)CCCC1.
What is the InChIKey of 4-methyl-1-(1-methylcyclopentyl)-N-propylpentan-1-amine?
The InChIKey is LUUXBMODWNQBSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N/c1-5-12-16-14(9-8-13(2)3)15(4)10-6-7-11-15/h13-14,16H,5-12H2,1-4H3.
What are the key properties of 4-methyl-1-(1-methylcyclopentyl)-N-propylpentan-1-amine?
4-methyl-1-(1-methylcyclopentyl)-N-propylpentan-1-amine has a molecular weight of 225.42 g/mol, XLogP of 4.37, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-(1-methylcyclopentyl)-N-propylpentan-1-amine is sourced from PubChem (CID 115834516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).