JRB

2-PIPERAZIN-1-YL-ANILINE

Created:	2014-12-04
Last modified:	2015-05-13

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1 entries where JRB is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	28
Chiral Atom Count	0
Bond Count	29
Aromatic Bond Count	6

2D diagram of JRB

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Chemical Component Summary
Name	2-PIPERAZIN-1-YL-ANILINE
Systematic Name (OpenEye OEToolkits)	2-piperazin-1-ylaniline
Formula	C₁₀ H₁₅ N₃
Molecular Weight	177.246
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	c1c(c(ccc1)N2CCNCC2)N
SMILES	CACTVS	3.385	Nc1ccccc1N2CCNCC2
SMILES	OpenEye OEToolkits	1.7.6	c1ccc(c(c1)N)N2CCNCC2
Canonical SMILES	CACTVS	3.385	Nc1ccccc1N2CCNCC2
Canonical SMILES	OpenEye OEToolkits	1.7.6	c1ccc(c(c1)N)N2CCNCC2
InChI	InChI	1.03	InChI=1S/C10H15N3/c11-9-3-1-2-4-10(9)13-7-5-12-6-8-13/h1-4,12H,5-8,11H2
InChIKey	InChI	1.03	TZWRXFPFRACRLO-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	430956

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