2AQ

QUINOLIN-2-AMINE

Created:	2007-01-12
Last modified:	2021-03-01

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5 entries where 2AQ is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	19
Chiral Atom Count	0
Bond Count	20
Aromatic Bond Count	11

2D diagram of 2AQ

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Chemical Component Summary
Name	QUINOLIN-2-AMINE
Synonyms	2-AMINOQUINOLINE
Systematic Name (OpenEye OEToolkits)	quinolin-2-amine
Formula	C₉ H₈ N₂
Molecular Weight	144.173
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	10.04	n1c(ccc2ccccc12)N
SMILES	CACTVS	3.341	Nc1ccc2ccccc2n1
SMILES	OpenEye OEToolkits	1.5.0	c1ccc2c(c1)ccc(n2)N
Canonical SMILES	CACTVS	3.341	Nc1ccc2ccccc2n1
Canonical SMILES	OpenEye OEToolkits	1.5.0	c1ccc2c(c1)ccc(n2)N
InChI	InChI	1.03	InChI=1S/C9H8N2/c10-9-6-5-7-3-1-2-4-8(7)11-9/h1-6H,(H2,10,11)
InChIKey	InChI	1.03	GCMNJUJAKQGROZ-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	11379
ChEMBL	CHEMBL61236

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