About N-cyclopropyl-1-azabicyclo[3.2.1]octan-4-amine
N-cyclopropyl-1-azabicyclo[3.2.1]octan-4-amine (PubChem CID 105363554) has the molecular formula C10H18N2
and a molecular weight of 166.27 g/mol. Its IUPAC name is N-cyclopropyl-1-azabicyclo[3.2.1]octan-4-amine.
Molecular Properties
| Compound Name | N-cyclopropyl-1-azabicyclo[3.2.1]octan-4-amine |
| PubChem CID | 105363554 |
| Molecular Formula | C10H18N2 |
| Molecular Weight | 166.27 g/mol |
| Exact Mass | 166.15 |
| IUPAC Name | N-cyclopropyl-1-azabicyclo[3.2.1]octan-4-amine |
| SMILES | C1CC1NC1CCN2CCC1C2 |
| InChI | InChI=1S/C10H18N2/c1-2-9(1)11-10-4-6-12-5-3-8(10)7-12/h8-11H,1-7H2 |
| InChIKey | BUSULDGWLYFFAX-UHFFFAOYSA-N |
| XLogP | 0.83 |
| TPSA | 15.27 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 12 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 166.27 |
| LogP ≤ 5 | 0.83 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of N-cyclopropyl-1-azabicyclo[3.2.1]octan-4-amine?
The IUPAC name of N-cyclopropyl-1-azabicyclo[3.2.1]octan-4-amine (CID 105363554) is N-cyclopropyl-1-azabicyclo[3.2.1]octan-4-amine.
What is the SMILES notation for N-cyclopropyl-1-azabicyclo[3.2.1]octan-4-amine?
The canonical SMILES for N-cyclopropyl-1-azabicyclo[3.2.1]octan-4-amine is C1CC1NC1CCN2CCC1C2.
What is the InChIKey of N-cyclopropyl-1-azabicyclo[3.2.1]octan-4-amine?
The InChIKey is BUSULDGWLYFFAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2/c1-2-9(1)11-10-4-6-12-5-3-8(10)7-12/h8-11H,1-7H2.
What are the key properties of N-cyclopropyl-1-azabicyclo[3.2.1]octan-4-amine?
N-cyclopropyl-1-azabicyclo[3.2.1]octan-4-amine has a molecular weight of 166.27 g/mol, XLogP of 0.83, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-1-azabicyclo[3.2.1]octan-4-amine is sourced from PubChem (CID 105363554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).