A1CFT
1-[5-(4-fluorophenyl)-1H-imidazol-2-yl]methanamine
| Created: | 2025-06-09 |
| Last modified: | 2025-11-05 |
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Chemical Details | |
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| Formal Charge | 0 |
| Atom Count | 24 |
| Chiral Atom Count | 0 |
| Bond Count | 25 |
| Aromatic Bond Count | 11 |
Chemical Component Summary | |
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| Name | 1-[5-(4-fluorophenyl)-1H-imidazol-2-yl]methanamine |
| Systematic Name (OpenEye OEToolkits) | [5-(4-fluorophenyl)-1~{H}-imidazol-2-yl]methanamine |
| Formula | C10 H10 F N3 |
| Molecular Weight | 191.205 |
| Type | NON-POLYMER |
Chemical Descriptors | |||
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| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | NCc1ncc([NH]1)c1ccc(F)cc1 |
| SMILES | CACTVS | 3.385 | NCc1[nH]c(cn1)c2ccc(F)cc2 |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | c1cc(ccc1c2cnc([nH]2)CN)F |
| Canonical SMILES | CACTVS | 3.385 | NCc1[nH]c(cn1)c2ccc(F)cc2 |
| Canonical SMILES | OpenEye OEToolkits | 3.1.0.0 | c1cc(ccc1c2cnc([nH]2)CN)F |
| InChI | InChI | 1.06 | InChI=1S/C10H10FN3/c11-8-3-1-7(2-4-8)9-6-13-10(5-12)14-9/h1-4,6H,5,12H2,(H,13,14) |
| InChIKey | InChI | 1.06 | AJSVWOCYSPNHEA-UHFFFAOYSA-N |
Related Resource References
| Resource Name | Reference |
|---|---|
| PubChem | 43649246 |
| ChEMBL | CHEMBL4532756 |














