P0K

6-[[furan-2-ylmethyl(methyl)amino]methyl]-5~{H}-pyrimidine-2,4-dione

Created:2020-04-14
Last modified:  2020-07-15

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Chemical Details

Formal Charge0
Atom Count30
Chiral Atom Count0
Bond Count31
Aromatic Bond Count5
2D diagram of P0K

Chemical Component Summary

Name6-[[furan-2-ylmethyl(methyl)amino]methyl]-5~{H}-pyrimidine-2,4-dione
Systematic Name (OpenEye OEToolkits)6-[[furan-2-ylmethyl(methyl)amino]methyl]-5~{H}-pyrimidine-2,4-dione
FormulaC11 H13 N3 O3
Molecular Weight235.239
TypeNON-POLYMER

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESCACTVS3.385CN(CC1=NC(=O)NC(=O)C1)Cc2occc2
SMILESOpenEye OEToolkits2.0.7CN(Cc1ccco1)CC2=NC(=O)NC(=O)C2
Canonical SMILESCACTVS3.385 CN(CC1=NC(=O)NC(=O)C1)Cc2occc2
Canonical SMILESOpenEye OEToolkits2.0.7 CN(Cc1ccco1)CC2=NC(=O)NC(=O)C2
InChIInChI1.03 InChI=1S/C11H13N3O3/c1-14(7-9-3-2-4-17-9)6-8-5-10(15)13-11(16)12-8/h2-4H,5-7H2,1H3,(H,13,15,16)
InChIKeyInChI1.03 PWXNLVGSEBBXAV-UHFFFAOYSA-N

Related Resource References

Resource NameReference
PubChem 146681122