About N-butyl-N-propylpyrrolidin-2-amine
N-butyl-N-propylpyrrolidin-2-amine (PubChem CID 90707555) has the molecular formula C11H24N2
and a molecular weight of 184.33 g/mol. Its IUPAC name is N-butyl-N-propylpyrrolidin-2-amine.
Molecular Properties
| Compound Name | N-butyl-N-propylpyrrolidin-2-amine |
| PubChem CID | 90707555 |
| Molecular Formula | C11H24N2 |
| Molecular Weight | 184.33 g/mol |
| Exact Mass | 184.19 |
| IUPAC Name | N-butyl-N-propylpyrrolidin-2-amine |
| SMILES | CCCCN(CCC)C1CCCN1 |
| InChI | InChI=1S/C11H24N2/c1-3-5-10-13(9-4-2)11-7-6-8-12-11/h11-12H,3-10H2,1-2H3 |
| InChIKey | YJFKGTQDYRUNBI-UHFFFAOYSA-N |
| XLogP | 2.21 |
| TPSA | 15.27 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 13 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 184.33 |
| LogP ≤ 5 | 2.21 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of N-butyl-N-propylpyrrolidin-2-amine?
The IUPAC name of N-butyl-N-propylpyrrolidin-2-amine (CID 90707555) is N-butyl-N-propylpyrrolidin-2-amine.
What is the SMILES notation for N-butyl-N-propylpyrrolidin-2-amine?
The canonical SMILES for N-butyl-N-propylpyrrolidin-2-amine is CCCCN(CCC)C1CCCN1.
What is the InChIKey of N-butyl-N-propylpyrrolidin-2-amine?
The InChIKey is YJFKGTQDYRUNBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2/c1-3-5-10-13(9-4-2)11-7-6-8-12-11/h11-12H,3-10H2,1-2H3.
What are the key properties of N-butyl-N-propylpyrrolidin-2-amine?
N-butyl-N-propylpyrrolidin-2-amine has a molecular weight of 184.33 g/mol, XLogP of 2.21, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-N-propylpyrrolidin-2-amine is sourced from PubChem (CID 90707555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).