QPN
1-[1-(3-fluorophenyl)-6,7-dihydro-4~{H}-pyrazolo[4,3-c]pyridin-5-yl]propan-1-one
Created: | 2020-07-17 |
Last modified: | 2021-07-28 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 36 |
Chiral Atom Count | 0 |
Bond Count | 38 |
Aromatic Bond Count | 11 |
Chemical Component Summary | |
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Name | 1-[1-(3-fluorophenyl)-6,7-dihydro-4~{H}-pyrazolo[4,3-c]pyridin-5-yl]propan-1-one |
Systematic Name (OpenEye OEToolkits) | 1-[1-(3-fluorophenyl)-6,7-dihydro-4~{H}-pyrazolo[4,3-c]pyridin-5-yl]propan-1-one |
Formula | C15 H16 F N3 O |
Molecular Weight | 273.305 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | CACTVS | 3.385 | CCC(=O)N1CCc2n(ncc2C1)c3cccc(F)c3 |
SMILES | OpenEye OEToolkits | 2.0.7 | CCC(=O)N1CCc2c(cnn2c3cccc(c3)F)C1 |
Canonical SMILES | CACTVS | 3.385 | CCC(=O)N1CCc2n(ncc2C1)c3cccc(F)c3 |
Canonical SMILES | OpenEye OEToolkits | 2.0.7 | CCC(=O)N1CCc2c(cnn2c3cccc(c3)F)C1 |
InChI | InChI | 1.03 | InChI=1S/C15H16FN3O/c1-2-15(20)18-7-6-14-11(10-18)9-17-19(14)13-5-3-4-12(16)8-13/h3-5,8-9H,2,6-7,10H2,1H3 |
InChIKey | InChI | 1.03 | PBPQRCMCEYVHIP-UHFFFAOYSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 156022397 |