zinc bis(8H-quinolin-8-ide)

C18H12N2Zn — CID 151932686

IUPACzinc bis(8H-quinolin-8-ide)
SMILES[Zn+2].[c-]1cccc2cccnc12.[c-]1cccc2cccnc12
InChIInChI=1S/2C9H6N.Zn/c2*1-2-6-9-8(4-1)5-3-7-10-9;/h2*1-5,7H;/q2*-1;+2
InChIKeyHXJBOFXAGQKMRU-UHFFFAOYSA-N
MW321.70 g/mol
LogP4.07
Rot. Bonds

About zinc bis(8H-quinolin-8-ide)

zinc bis(8H-quinolin-8-ide) (PubChem CID 151932686) has the molecular formula C18H12N2Zn and a molecular weight of 321.70 g/mol. Its IUPAC name is zinc bis(8H-quinolin-8-ide).

Molecular Properties

Compound Namezinc bis(8H-quinolin-8-ide)
PubChem CID151932686
Molecular FormulaC18H12N2Zn
Molecular Weight321.70 g/mol
Exact Mass320.03
IUPAC Namezinc bis(8H-quinolin-8-ide)
SMILES[Zn+2].[c-]1cccc2cccnc12.[c-]1cccc2cccnc12
InChIInChI=1S/2C9H6N.Zn/c2*1-2-6-9-8(4-1)5-3-7-10-9;/h2*1-5,7H;/q2*-1;+2
InChIKeyHXJBOFXAGQKMRU-UHFFFAOYSA-N
XLogP4.07
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.70
LogP ≤ 54.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

8-Lithioquinoline
CID 12575023
6h,7h-Quinoline
CID 67835501
(1Z,11Z,13Z,15Z)-3,5,22,24-tetrazapentacyclo[14.8.0.02,11.04,9.018,23]tetracosa-1,3,5,7,9,11,13,15,17,19,21,23-dodecaene
CID 134980792
12,16,17-Triazatetracyclo[7.7.1.02,7.013,17]heptadeca-1,3,5,7,9,11,13,15-octaene
CID 135082282
gold(1+);8H-quinolin-8-ide
CID 12575030
copper bis(8H-quinolin-8-ide)
CID 13602417
copper(1+);8H-quinolin-8-ide
CID 20186220
6-(6H-1,10-phenanthrolin-6-id-5-yl)-5H-1,10-phenanthrolin-5-ide;yttrium
CID 58813795
iridium(3+);tris(8H-quinolin-8-ide)
CID 60068969
carbanide;8H-quinolin-8-ide;yttrium
CID 60099048
magnesium bis(8H-quinolin-8-ide)
CID 87786174
calcium bis(5-chloro-8H-quinolin-8-ide)
CID 87786487

Frequently Asked Questions

What is the IUPAC name of zinc bis(8H-quinolin-8-ide)?
The IUPAC name of zinc bis(8H-quinolin-8-ide) (CID 151932686) is zinc bis(8H-quinolin-8-ide).
What is the SMILES notation for zinc bis(8H-quinolin-8-ide)?
The canonical SMILES for zinc bis(8H-quinolin-8-ide) is [Zn+2].[c-]1cccc2cccnc12.[c-]1cccc2cccnc12.
What is the InChIKey of zinc bis(8H-quinolin-8-ide)?
The InChIKey is HXJBOFXAGQKMRU-UHFFFAOYSA-N. The full InChI is InChI=1S/2C9H6N.Zn/c2*1-2-6-9-8(4-1)5-3-7-10-9;/h2*1-5,7H;/q2*-1;+2.
What are the key properties of zinc bis(8H-quinolin-8-ide)?
zinc bis(8H-quinolin-8-ide) has a molecular weight of 321.70 g/mol, XLogP of 4.07, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for zinc bis(8H-quinolin-8-ide) is sourced from PubChem (CID 151932686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).