About 1-cyclopropyl-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]methanamine
1-cyclopropyl-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]methanamine (PubChem CID 61013267) has the molecular formula C13H24N2
and a molecular weight of 208.35 g/mol. Its IUPAC name is 1-cyclopropyl-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]methanamine.
Molecular Properties
| Compound Name | 1-cyclopropyl-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]methanamine |
| PubChem CID | 61013267 |
| Molecular Formula | C13H24N2 |
| Molecular Weight | 208.35 g/mol |
| Exact Mass | 208.19 |
| IUPAC Name | 1-cyclopropyl-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]methanamine |
| SMILES | CN1C2CCC1CC(CNCC1CC1)C2 |
| InChI | InChI=1S/C13H24N2/c1-15-12-4-5-13(15)7-11(6-12)9-14-8-10-2-3-10/h10-14H,2-9H2,1H3 |
| InChIKey | LBZWLNZIZMYIBM-UHFFFAOYSA-N |
| XLogP | 1.86 |
| TPSA | 15.27 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 208.35 |
| LogP ≤ 5 | 1.86 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 1-cyclopropyl-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]methanamine?
The IUPAC name of 1-cyclopropyl-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]methanamine (CID 61013267) is 1-cyclopropyl-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]methanamine.
What is the SMILES notation for 1-cyclopropyl-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]methanamine?
The canonical SMILES for 1-cyclopropyl-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]methanamine is CN1C2CCC1CC(CNCC1CC1)C2.
What is the InChIKey of 1-cyclopropyl-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]methanamine?
The InChIKey is LBZWLNZIZMYIBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2/c1-15-12-4-5-13(15)7-11(6-12)9-14-8-10-2-3-10/h10-14H,2-9H2,1H3.
What are the key properties of 1-cyclopropyl-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]methanamine?
1-cyclopropyl-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]methanamine has a molecular weight of 208.35 g/mol, XLogP of 1.86, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]methanamine is sourced from PubChem (CID 61013267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).