gold(1+);8H-quinolin-8-ide

C9H6AuN — CID 12575030

IUPACgold(1+);8H-quinolin-8-ide
SMILES[Au+].[c-]1cccc2cccnc12
InChIInChI=1S/C9H6N.Au/c1-2-6-9-8(4-1)5-3-7-10-9;/h1-5,7H;/q-1;+1
InChIKeyROAVZKFYNSDLPC-UHFFFAOYSA-N
MW325.12 g/mol
LogP2.03
Rot. Bonds

About gold(1+);8H-quinolin-8-ide

gold(1+);8H-quinolin-8-ide (PubChem CID 12575030) has the molecular formula C9H6AuN and a molecular weight of 325.12 g/mol. Its IUPAC name is gold(1+);8H-quinolin-8-ide.

Molecular Properties

Compound Namegold(1+);8H-quinolin-8-ide
PubChem CID12575030
Molecular FormulaC9H6AuN
Molecular Weight325.12 g/mol
Exact Mass325.02
IUPAC Namegold(1+);8H-quinolin-8-ide
SMILES[Au+].[c-]1cccc2cccnc12
InChIInChI=1S/C9H6N.Au/c1-2-6-9-8(4-1)5-3-7-10-9;/h1-5,7H;/q-1;+1
InChIKeyROAVZKFYNSDLPC-UHFFFAOYSA-N
XLogP2.03
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.12
LogP ≤ 52.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

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CID 12200782
8-Lithioquinoline
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Bis(carbene)pyridine
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6h,7h-Quinoline
CID 67835501
Cyclopentindole
CID 88133445
CID 89317106
CID 89317106
(2Z)-2-(1-fluoroprop-2-enylidene)-3-methylidenepyridine
CID 144425521
7,7-difluoro-6H-quinoline
CID 152283186
4-Fluoro-2,7-dimethylideneazecine
CID 169963172
8-Quinolylmagnesium chloride
CID 129860432
Methylenedibenzoazepine
CID 129872675

Frequently Asked Questions

What is the IUPAC name of gold(1+);8H-quinolin-8-ide?
The IUPAC name of gold(1+);8H-quinolin-8-ide (CID 12575030) is gold(1+);8H-quinolin-8-ide.
What is the SMILES notation for gold(1+);8H-quinolin-8-ide?
The canonical SMILES for gold(1+);8H-quinolin-8-ide is [Au+].[c-]1cccc2cccnc12.
What is the InChIKey of gold(1+);8H-quinolin-8-ide?
The InChIKey is ROAVZKFYNSDLPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H6N.Au/c1-2-6-9-8(4-1)5-3-7-10-9;/h1-5,7H;/q-1;+1.
What are the key properties of gold(1+);8H-quinolin-8-ide?
gold(1+);8H-quinolin-8-ide has a molecular weight of 325.12 g/mol, XLogP of 2.03, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for gold(1+);8H-quinolin-8-ide is sourced from PubChem (CID 12575030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).