5-(Diethylamino)uracil

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Basic information

CAS: 55476-36-3
Standard SMILES: CCN(CC)c1c[nH]c(=O)[nH]c1=O
InChIKey: QJNAQOWKHVJJHZ-UHFFFAOYSA-N
Molecular formula: C8H13N3O2
Average molar mass: 183.21 g/mol
Monoisotopic mass: 183.10077667

Names & identifiers

Preferred name: 5-(Diethylamino)uracil
IUPAC: 5-(diethylamino)-1H-pyrimidine-2,4-dione
English name: 5-(Diethylamino)uracil
Molecular formula: C8H13N3O2
Molecular weight: 183.21

Names & synonyms

5-(Diethylamino)uracil55476-36-35-(diethylamino)-1H-pyrimidine-2,4-dione5-(diethylamino)pyrimidine-2,4(1H,3H)-dioneDTXSID90392946AKOS006272480DB-081533EU-00683952,4(1H,3H)-Pyrimidinedione, 5-(diethylamino)-

Database identifiers

CAS: 55476-36-3
PubChem CID: 3487741
DTXSID: DTXSID90392946

Properties

Computed structural properties

XLogP: 0.1
Topological polar surface area: 61.4 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 3
Rotatable bonds: 3
Heavy atoms: 13
Formal charge: 0
Complexity: 256

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Compound notes

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