About 1-(2-fluoro-5-methoxyphenyl)imidazol-2-amine
1-(2-fluoro-5-methoxyphenyl)imidazol-2-amine (PubChem CID 106576957) has the molecular formula C10H10FN3O
and a molecular weight of 207.21 g/mol. Its IUPAC name is 1-(2-fluoro-5-methoxyphenyl)imidazol-2-amine.
Molecular Properties
| Compound Name | 1-(2-fluoro-5-methoxyphenyl)imidazol-2-amine |
| PubChem CID | 106576957 |
| Molecular Formula | C10H10FN3O |
| Molecular Weight | 207.21 g/mol |
| Exact Mass | 207.08 |
| IUPAC Name | 1-(2-fluoro-5-methoxyphenyl)imidazol-2-amine |
| SMILES | COc1ccc(F)c(-n2ccnc2N)c1 |
| InChI | InChI=1S/C10H10FN3O/c1-15-7-2-3-8(11)9(6-7)14-5-4-13-10(14)12/h2-6H,1H3,(H2,12,13) |
| InChIKey | KLXXCDOFGJBSKE-UHFFFAOYSA-N |
| XLogP | 1.60 |
| TPSA | 53.07 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 207.21 |
| LogP ≤ 5 | 1.60 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 4 |
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Frequently Asked Questions
What is the IUPAC name of 1-(2-fluoro-5-methoxyphenyl)imidazol-2-amine?
The IUPAC name of 1-(2-fluoro-5-methoxyphenyl)imidazol-2-amine (CID 106576957) is 1-(2-fluoro-5-methoxyphenyl)imidazol-2-amine.
What is the SMILES notation for 1-(2-fluoro-5-methoxyphenyl)imidazol-2-amine?
The canonical SMILES for 1-(2-fluoro-5-methoxyphenyl)imidazol-2-amine is COc1ccc(F)c(-n2ccnc2N)c1.
What is the InChIKey of 1-(2-fluoro-5-methoxyphenyl)imidazol-2-amine?
The InChIKey is KLXXCDOFGJBSKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10FN3O/c1-15-7-2-3-8(11)9(6-7)14-5-4-13-10(14)12/h2-6H,1H3,(H2,12,13).
What are the key properties of 1-(2-fluoro-5-methoxyphenyl)imidazol-2-amine?
1-(2-fluoro-5-methoxyphenyl)imidazol-2-amine has a molecular weight of 207.21 g/mol, XLogP of 1.60, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluoro-5-methoxyphenyl)imidazol-2-amine is sourced from PubChem (CID 106576957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).