About N-(3-bicyclo[3.1.0]hexanyl)-5-fluoropyridin-2-amine
N-(3-bicyclo[3.1.0]hexanyl)-5-fluoropyridin-2-amine (PubChem CID 130791657) has the molecular formula C11H13FN2
and a molecular weight of 192.24 g/mol. Its IUPAC name is N-(3-bicyclo[3.1.0]hexanyl)-5-fluoropyridin-2-amine.
Molecular Properties
| Compound Name | N-(3-bicyclo[3.1.0]hexanyl)-5-fluoropyridin-2-amine |
| PubChem CID | 130791657 |
| Molecular Formula | C11H13FN2 |
| Molecular Weight | 192.24 g/mol |
| Exact Mass | 192.11 |
| IUPAC Name | N-(3-bicyclo[3.1.0]hexanyl)-5-fluoropyridin-2-amine |
| SMILES | Fc1ccc(NC2CC3CC3C2)nc1 |
| InChI | InChI=1S/C11H13FN2/c12-9-1-2-11(13-6-9)14-10-4-7-3-8(7)5-10/h1-2,6-8,10H,3-5H2,(H,13,14) |
| InChIKey | OPTUZJJGUSOHHV-UHFFFAOYSA-N |
| XLogP | 2.43 |
| TPSA | 24.92 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 192.24 |
| LogP ≤ 5 | 2.43 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of N-(3-bicyclo[3.1.0]hexanyl)-5-fluoropyridin-2-amine?
The IUPAC name of N-(3-bicyclo[3.1.0]hexanyl)-5-fluoropyridin-2-amine (CID 130791657) is N-(3-bicyclo[3.1.0]hexanyl)-5-fluoropyridin-2-amine.
What is the SMILES notation for N-(3-bicyclo[3.1.0]hexanyl)-5-fluoropyridin-2-amine?
The canonical SMILES for N-(3-bicyclo[3.1.0]hexanyl)-5-fluoropyridin-2-amine is Fc1ccc(NC2CC3CC3C2)nc1.
What is the InChIKey of N-(3-bicyclo[3.1.0]hexanyl)-5-fluoropyridin-2-amine?
The InChIKey is OPTUZJJGUSOHHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13FN2/c12-9-1-2-11(13-6-9)14-10-4-7-3-8(7)5-10/h1-2,6-8,10H,3-5H2,(H,13,14).
What are the key properties of N-(3-bicyclo[3.1.0]hexanyl)-5-fluoropyridin-2-amine?
N-(3-bicyclo[3.1.0]hexanyl)-5-fluoropyridin-2-amine has a molecular weight of 192.24 g/mol, XLogP of 2.43, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-bicyclo[3.1.0]hexanyl)-5-fluoropyridin-2-amine is sourced from PubChem (CID 130791657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).