RJ8

4-(1-benzofuran-5-yl)pyridin-2-amine

Created:	2020-09-30
Last modified:	2021-05-26

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1 entries where RJ8 is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	26
Chiral Atom Count	0
Bond Count	28
Aromatic Bond Count	16

2D diagram of RJ8

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Chemical Component Summary
Name	4-(1-benzofuran-5-yl)pyridin-2-amine
Systematic Name (OpenEye OEToolkits)	4-(1-benzofuran-5-yl)pyridin-2-amine
Formula	C₁₃ H₁₀ N₂ O
Molecular Weight	210.231
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	Nc1cc(ccn1)c2ccc3occc3c2
SMILES	OpenEye OEToolkits	2.0.7	c1cc2c(cco2)cc1c3ccnc(c3)N
Canonical SMILES	CACTVS	3.385	Nc1cc(ccn1)c2ccc3occc3c2
Canonical SMILES	OpenEye OEToolkits	2.0.7	c1cc2c(cco2)cc1c3ccnc(c3)N
InChI	InChI	1.03	InChI=1S/C13H10N2O/c14-13-8-10(3-5-15-13)9-1-2-12-11(7-9)4-6-16-12/h1-8H,(H2,14,15)
InChIKey	InChI	1.03	AESBNYUOPVLZJY-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	155920136

RCSB PDB Core Operations are funded by the U.S. National Science Foundation (DBI-2321666), the US Department of Energy (DE-SC0019749), and the National Cancer Institute, National Institute of Allergy and Infectious Diseases, and National Institute of General Medical Sciences of the National Institutes of Health under grant R01GM157729.