FI9
5-(4-azanylpiperidin-1-yl)carbonyl-1~{H}-pyridin-2-one
Created: | 2022-01-24 |
Last modified: | 2022-09-28 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 31 |
Chiral Atom Count | 0 |
Bond Count | 32 |
Aromatic Bond Count | 0 |
Chemical Component Summary | |
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Name | 5-(4-azanylpiperidin-1-yl)carbonyl-1~{H}-pyridin-2-one |
Systematic Name (OpenEye OEToolkits) | 5-(4-azanylpiperidin-1-yl)carbonyl-1~{H}-pyridin-2-one |
Formula | C11 H15 N3 O2 |
Molecular Weight | 221.256 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | CACTVS | 3.385 | NC1CCN(CC1)C(=O)C2=CNC(=O)C=C2 |
SMILES | OpenEye OEToolkits | 2.0.7 | C1CN(CCC1N)C(=O)C2=CNC(=O)C=C2 |
Canonical SMILES | CACTVS | 3.385 | NC1CCN(CC1)C(=O)C2=CNC(=O)C=C2 |
Canonical SMILES | OpenEye OEToolkits | 2.0.7 | C1CN(CCC1N)C(=O)C2=CNC(=O)C=C2 |
InChI | InChI | 1.06 | InChI=1S/C11H15N3O2/c12-9-3-5-14(6-4-9)11(16)8-1-2-10(15)13-7-8/h1-2,7,9H,3-6,12H2,(H,13,15) |
InChIKey | InChI | 1.06 | PBJCAAQZCVURJN-UHFFFAOYSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 43556202 |