2,3,4-trimethyl-8H-quinolin-8-ide;yttrium

C12H12NY- — CID 59977116

IUPAC2,3,4-trimethyl-8H-quinolin-8-ide;yttrium
SMILESCc1nc2[c-]cccc2c(C)c1C.[Y]
InChIInChI=1S/C12H12N.Y/c1-8-9(2)11-6-4-5-7-12(11)13-10(8)3;/h4-6H,1-3H3;/q-1;
InChIKeyNYBCQYHUHGUXFM-UHFFFAOYSA-N
MW259.14 g/mol
LogP2.96
Rot. Bonds

About 2,3,4-trimethyl-8H-quinolin-8-ide;yttrium

2,3,4-trimethyl-8H-quinolin-8-ide;yttrium (PubChem CID 59977116) has the molecular formula C12H12NY- and a molecular weight of 259.14 g/mol. Its IUPAC name is 2,3,4-trimethyl-8H-quinolin-8-ide;yttrium.

Molecular Properties

Compound Name2,3,4-trimethyl-8H-quinolin-8-ide;yttrium
PubChem CID59977116
Molecular FormulaC12H12NY-
Molecular Weight259.14 g/mol
Exact Mass259.00
IUPAC Name2,3,4-trimethyl-8H-quinolin-8-ide;yttrium
SMILESCc1nc2[c-]cccc2c(C)c1C.[Y]
InChIInChI=1S/C12H12N.Y/c1-8-9(2)11-6-4-5-7-12(11)13-10(8)3;/h4-6H,1-3H3;/q-1;
InChIKeyNYBCQYHUHGUXFM-UHFFFAOYSA-N
XLogP2.96
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.14
LogP ≤ 52.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 2,3,4-trimethyl-8H-quinolin-8-ide;yttrium with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4H-Carbazole
CID 19360791
2H-carbazole
CID 19830578
Cyclopentacarbazole
CID 21887528
4-Methyl-2,3-dihydroquinoline
CID 68274032
2,2,4-Trimethyl-2,6-dihydroquinoline
CID 20760318
(1Z,9Z)-9,10-dimethyl-8,11-diazatricyclo[10.4.0.02,7]hexadeca-1,3,5,7,9,11,13,15-octaene
CID 134989464
CID 164683315
CID 164683315
1H-benzo[b]carbazole
CID 15089918
2,2-Dimethylcarbazole
CID 18471893
7,10-dihydro-6H-benzo[b][1]benzazepine
CID 22063027
15-Azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(15),2,4,6,8,11,13-heptaene
CID 54107119
ethane;7-methyl-4H-quinolin-4-ide;yttrium
CID 57629436

Frequently Asked Questions

What is the IUPAC name of 2,3,4-trimethyl-8H-quinolin-8-ide;yttrium?
The IUPAC name of 2,3,4-trimethyl-8H-quinolin-8-ide;yttrium (CID 59977116) is 2,3,4-trimethyl-8H-quinolin-8-ide;yttrium.
What is the SMILES notation for 2,3,4-trimethyl-8H-quinolin-8-ide;yttrium?
The canonical SMILES for 2,3,4-trimethyl-8H-quinolin-8-ide;yttrium is Cc1nc2[c-]cccc2c(C)c1C.[Y].
What is the InChIKey of 2,3,4-trimethyl-8H-quinolin-8-ide;yttrium?
The InChIKey is NYBCQYHUHGUXFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N.Y/c1-8-9(2)11-6-4-5-7-12(11)13-10(8)3;/h4-6H,1-3H3;/q-1;.
What are the key properties of 2,3,4-trimethyl-8H-quinolin-8-ide;yttrium?
2,3,4-trimethyl-8H-quinolin-8-ide;yttrium has a molecular weight of 259.14 g/mol, XLogP of 2.96, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,4-trimethyl-8H-quinolin-8-ide;yttrium is sourced from PubChem (CID 59977116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).