JNE

6-methyl-~{N}-(phenylmethyl)pyridin-2-amine

Created:	2019-03-13
Last modified:	2020-04-01

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2 entries where JNE is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	29
Chiral Atom Count	0
Bond Count	30
Aromatic Bond Count	12

2D diagram of JNE

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Chemical Component Summary
Name	6-methyl-~{N}-(phenylmethyl)pyridin-2-amine
Systematic Name (OpenEye OEToolkits)	6-methyl-~{N}-(phenylmethyl)pyridin-2-amine
Formula	C₁₃ H₁₄ N₂
Molecular Weight	198.264
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	Cc1cccc(NCc2ccccc2)n1
SMILES	OpenEye OEToolkits	2.0.7	Cc1cccc(n1)NCc2ccccc2
Canonical SMILES	CACTVS	3.385	Cc1cccc(NCc2ccccc2)n1
Canonical SMILES	OpenEye OEToolkits	2.0.7	Cc1cccc(n1)NCc2ccccc2
InChI	InChI	1.03	InChI=1S/C13H14N2/c1-11-6-5-9-13(15-11)14-10-12-7-3-2-4-8-12/h2-9H,10H2,1H3,(H,14,15)
InChIKey	InChI	1.03	FJZQUYGOKRVORO-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	112445
ChEMBL	CHEMBL211000

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.