About N-cyclopropyl-5-methoxypyridin-2-amine
N-cyclopropyl-5-methoxypyridin-2-amine (PubChem CID 106503930) has the molecular formula C9H12N2O
and a molecular weight of 164.21 g/mol. Its IUPAC name is N-cyclopropyl-5-methoxypyridin-2-amine.
Molecular Properties
| Compound Name | N-cyclopropyl-5-methoxypyridin-2-amine |
| PubChem CID | 106503930 |
| Molecular Formula | C9H12N2O |
| Molecular Weight | 164.21 g/mol |
| Exact Mass | 164.09 |
| IUPAC Name | N-cyclopropyl-5-methoxypyridin-2-amine |
| SMILES | COc1ccc(NC2CC2)nc1 |
| InChI | InChI=1S/C9H12N2O/c1-12-8-4-5-9(10-6-8)11-7-2-3-7/h4-7H,2-3H2,1H3,(H,10,11) |
| InChIKey | WNHBOOFNGSFPAJ-UHFFFAOYSA-N |
| XLogP | 1.66 |
| TPSA | 34.15 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 12 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 164.21 |
| LogP ≤ 5 | 1.66 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of N-cyclopropyl-5-methoxypyridin-2-amine?
The IUPAC name of N-cyclopropyl-5-methoxypyridin-2-amine (CID 106503930) is N-cyclopropyl-5-methoxypyridin-2-amine.
What is the SMILES notation for N-cyclopropyl-5-methoxypyridin-2-amine?
The canonical SMILES for N-cyclopropyl-5-methoxypyridin-2-amine is COc1ccc(NC2CC2)nc1.
What is the InChIKey of N-cyclopropyl-5-methoxypyridin-2-amine?
The InChIKey is WNHBOOFNGSFPAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2O/c1-12-8-4-5-9(10-6-8)11-7-2-3-7/h4-7H,2-3H2,1H3,(H,10,11).
What are the key properties of N-cyclopropyl-5-methoxypyridin-2-amine?
N-cyclopropyl-5-methoxypyridin-2-amine has a molecular weight of 164.21 g/mol, XLogP of 1.66, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-5-methoxypyridin-2-amine is sourced from PubChem (CID 106503930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).