U3K

~{N}-methyl-~{N}-[(5-methylfuran-2-yl)methyl]-1-phenyl-methanamine

Created: 2021-01-19
Last modified:  2022-01-12

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Chemical Details

Formal Charge0
Atom Count33
Chiral Atom Count0
Bond Count34
Aromatic Bond Count11
2D diagram of U3K

Chemical Component Summary

Name~{N}-methyl-~{N}-[(5-methylfuran-2-yl)methyl]-1-phenyl-methanamine
Systematic Name (OpenEye OEToolkits)~{N}-methyl-~{N}-[(5-methylfuran-2-yl)methyl]-1-phenyl-methanamine
FormulaC14 H17 N O
Molecular Weight215.291
TypeNON-POLYMER

Chemical Descriptors

TypeProgram Version Descriptor
SMILESCACTVS3.385CN(Cc1oc(C)cc1)Cc2ccccc2
SMILESOpenEye OEToolkits2.0.7Cc1ccc(o1)CN(C)Cc2ccccc2
Canonical SMILESCACTVS3.385 CN(Cc1oc(C)cc1)Cc2ccccc2
Canonical SMILESOpenEye OEToolkits2.0.7 Cc1ccc(o1)CN(C)Cc2ccccc2
InChIInChI1.03 InChI=1S/C14H17NO/c1-12-8-9-14(16-12)11-15(2)10-13-6-4-3-5-7-13/h3-9H,10-11H2,1-2H3
InChIKeyInChI1.03 PLXKOSIEYNAHBU-UHFFFAOYSA-N

Related Resource References

Resource NameReference
PubChem 782822