M1Z
6-pyrrolidin-1-yl-5~{H}-pyrimidine-2,4-dione
Created: | 2019-10-02 |
Last modified: | 2020-03-04 |
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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 | 0 |
Chemical Component Summary | |
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Name | 6-pyrrolidin-1-yl-5~{H}-pyrimidine-2,4-dione |
Systematic Name (OpenEye OEToolkits) | 6-pyrrolidin-1-yl-5~{H}-pyrimidine-2,4-dione |
Formula | C8 H11 N3 O2 |
Molecular Weight | 181.192 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | CACTVS | 3.385 | O=C1CC(=NC(=O)N1)N2CCCC2 |
SMILES | OpenEye OEToolkits | 2.0.7 | C1CCN(C1)C2=NC(=O)NC(=O)C2 |
Canonical SMILES | CACTVS | 3.385 | O=C1CC(=NC(=O)N1)N2CCCC2 |
Canonical SMILES | OpenEye OEToolkits | 2.0.7 | C1CCN(C1)C2=NC(=O)NC(=O)C2 |
InChI | InChI | 1.03 | InChI=1S/C8H11N3O2/c12-7-5-6(9-8(13)10-7)11-3-1-2-4-11/h1-5H2,(H,10,12,13) |
InChIKey | InChI | 1.03 | VVOJYMDKNPHWLV-UHFFFAOYSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 146018693 |