About 3-methyl-3-azabicyclo[3.1.0]hexane;N-methylmethanamine
3-methyl-3-azabicyclo[3.1.0]hexane;N-methylmethanamine (PubChem CID 142484502) has the molecular formula C8H18N2
and a molecular weight of 142.25 g/mol. Its IUPAC name is 3-methyl-3-azabicyclo[3.1.0]hexane;N-methylmethanamine.
Molecular Properties
| Compound Name | 3-methyl-3-azabicyclo[3.1.0]hexane;N-methylmethanamine |
| PubChem CID | 142484502 |
| Molecular Formula | C8H18N2 |
| Molecular Weight | 142.25 g/mol |
| Exact Mass | 142.15 |
| IUPAC Name | 3-methyl-3-azabicyclo[3.1.0]hexane;N-methylmethanamine |
| SMILES | CN1CC2CC2C1.CNC |
| InChI | InChI=1S/C6H11N.C2H7N/c1-7-3-5-2-6(5)4-7;1-3-2/h5-6H,2-4H2,1H3;3H,1-2H3 |
| InChIKey | QSHCKIOBWRTYRB-UHFFFAOYSA-N |
| XLogP | 0.40 |
| TPSA | 15.27 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | |
| Heavy Atoms | 10 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 142.25 |
| LogP ≤ 5 | 0.40 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 3-methyl-3-azabicyclo[3.1.0]hexane;N-methylmethanamine?
The IUPAC name of 3-methyl-3-azabicyclo[3.1.0]hexane;N-methylmethanamine (CID 142484502) is 3-methyl-3-azabicyclo[3.1.0]hexane;N-methylmethanamine.
What is the SMILES notation for 3-methyl-3-azabicyclo[3.1.0]hexane;N-methylmethanamine?
The canonical SMILES for 3-methyl-3-azabicyclo[3.1.0]hexane;N-methylmethanamine is CN1CC2CC2C1.CNC.
What is the InChIKey of 3-methyl-3-azabicyclo[3.1.0]hexane;N-methylmethanamine?
The InChIKey is QSHCKIOBWRTYRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N.C2H7N/c1-7-3-5-2-6(5)4-7;1-3-2/h5-6H,2-4H2,1H3;3H,1-2H3.
What are the key properties of 3-methyl-3-azabicyclo[3.1.0]hexane;N-methylmethanamine?
3-methyl-3-azabicyclo[3.1.0]hexane;N-methylmethanamine has a molecular weight of 142.25 g/mol, XLogP of 0.40, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-3-azabicyclo[3.1.0]hexane;N-methylmethanamine is sourced from PubChem (CID 142484502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).