1-(1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)piperidine-4-carboxamide
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Basic information
- CAS
899011-57-5- Standard SMILES
Cn1c(=O)c2nc(N3CCC(C(N)=O)CC3)[nH]c2n(C)c1=O- InChIKey
ZLQUUJPZSHPLDC-UHFFFAOYSA-N- Molecular formula
- C13H18N6O3
- Average molar mass
- 306.32 g/mol
Names & identifiers
- Preferred name
- 1-(1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)piperidine-4-carboxamide
- IUPAC
- 1-(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)piperidine-4-carboxamide
- English name
- 1-(1,3-Dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)piperidine-4-carboxamide
- Molecular formula
- C13H18N6O3
- Molecular weight
- 306.32
Names & synonyms
1-(1,3-DIMETHYL-2,6-DIOXO-2,3,6,7-TETRAHYDRO-1H-PURIN-8-YL)-4-PIPERIDINECARBOXAMIDE1-(1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)piperidine-4-carboxamideSTK262574AKOS002321608ST507657821-(1,3-dimethyl-2,6-dioxo-1,3,7-trihydropurin-8-yl)piperidine-4-carboxamideTOSLAB 8715114-Piperidinecarboxamide, 1-(2,3,6,9-tetrahydro-1,3-dimethyl-2,6-dioxo-1H-purin-8-yl)-
Database identifiers
- CAS
899011-57-5
Properties
Computed structural propertiesFilling in
- XLogP
- -0.6
- Topological polar surface area
- 116 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 504
Related reactions
0 records
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Compound notes
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