RKH

4-(2-methyl-1-benzofuran-5-yl)pyridine-2,6-diamine

Created:	2020-10-01
Last modified:	2021-05-26

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1 entries where RKH is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	31
Chiral Atom Count	0
Bond Count	33
Aromatic Bond Count	16

2D diagram of RKH

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Chemical Component Summary
Name	4-(2-methyl-1-benzofuran-5-yl)pyridine-2,6-diamine
Systematic Name (OpenEye OEToolkits)	4-(2-methyl-1-benzofuran-5-yl)pyridine-2,6-diamine
Formula	C₁₄ H₁₃ N₃ O
Molecular Weight	239.273
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	Cc1oc2ccc(cc2c1)c3cc(N)nc(N)c3
SMILES	OpenEye OEToolkits	2.0.7	Cc1cc2cc(ccc2o1)c3cc(nc(c3)N)N
Canonical SMILES	CACTVS	3.385	Cc1oc2ccc(cc2c1)c3cc(N)nc(N)c3
Canonical SMILES	OpenEye OEToolkits	2.0.7	Cc1cc2cc(ccc2o1)c3cc(nc(c3)N)N
InChI	InChI	1.03	InChI=1S/C14H13N3O/c1-8-4-11-5-9(2-3-12(11)18-8)10-6-13(15)17-14(16)7-10/h2-7H,1H3,(H4,15,16,17)
InChIKey	InChI	1.03	BMBIGEJCNXQYPN-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	155920139

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