OTO

1-cyclopropylcarbonylpyrazolo[4,3-c]pyridine-3-carbonitrile

Created: 2022-09-20
Last modified:  2024-09-27

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Chemical Details

Formal Charge0
Atom Count24
Chiral Atom Count0
Bond Count26
Aromatic Bond Count10
2D diagram of OTO

Chemical Component Summary

Name1-cyclopropylcarbonylpyrazolo[4,3-c]pyridine-3-carbonitrile
Systematic Name (OpenEye OEToolkits)1-cyclopropylcarbonylpyrazolo[4,3-c]pyridine-3-carbonitrile
FormulaC11 H8 N4 O
Molecular Weight212.207
TypeNON-POLYMER

Chemical Descriptors

TypeProgram Version Descriptor
SMILESCACTVS3.385O=C(C1CC1)n2nc(C#N)c3cnccc23
SMILESOpenEye OEToolkits3.1.0.0c1cncc2c1n(nc2C#N)C(=O)C3CC3
Canonical SMILESCACTVS3.385 O=C(C1CC1)n2nc(C#N)c3cnccc23
Canonical SMILESOpenEye OEToolkits3.1.0.0 c1cncc2c1n(nc2C#N)C(=O)C3CC3
InChIInChI1.06 InChI=1S/C11H8N4O/c12-5-9-8-6-13-4-3-10(8)15(14-9)11(16)7-1-2-7/h3-4,6-7H,1-2H2
InChIKeyInChI1.06 DHYXAKZNFKQCOW-UHFFFAOYSA-N

Related Resource References

Resource NameReference
Pharos CHEMBL4753315
PubChem 162653838
ChEMBL CHEMBL4753315