(2-methyl-5-phenyl-1H-quinolin-2-yl)-quinolin-2-yldiazene

C25H20N4 — CID 155818085

IUPAC(2-methyl-5-phenyl-1H-quinolin-2-yl)-quinolin-2-yldiazene
SMILESCC1(/N=N/c2ccc3ccccc3n2)C=Cc2c(cccc2-c2ccccc2)N1
InChIInChI=1S/C25H20N4/c1-25(29-28-24-15-14-19-10-5-6-12-22(19)26-24)17-16-21-20(11-7-13-23(21)27-25)18-8-3-2-4-9-18/h2-17,27H,1H3/b29-28+
InChIKeyZHVAIPDUVJOZBF-ZQHSETAFSA-N
MW376.46 g/mol
LogP6.84
Rot. Bonds3

About (2-methyl-5-phenyl-1H-quinolin-2-yl)-quinolin-2-yldiazene

(2-methyl-5-phenyl-1H-quinolin-2-yl)-quinolin-2-yldiazene (PubChem CID 155818085) has the molecular formula C25H20N4 and a molecular weight of 376.46 g/mol. Its IUPAC name is (2-methyl-5-phenyl-1H-quinolin-2-yl)-quinolin-2-yldiazene.

Molecular Properties

Compound Name(2-methyl-5-phenyl-1H-quinolin-2-yl)-quinolin-2-yldiazene
PubChem CID155818085
Molecular FormulaC25H20N4
Molecular Weight376.46 g/mol
Exact Mass376.17
IUPAC Name(2-methyl-5-phenyl-1H-quinolin-2-yl)-quinolin-2-yldiazene
SMILESCC1(/N=N/c2ccc3ccccc3n2)C=Cc2c(cccc2-c2ccccc2)N1
InChIInChI=1S/C25H20N4/c1-25(29-28-24-15-14-19-10-5-6-12-22(19)26-24)17-16-21-20(11-7-13-23(21)27-25)18-8-3-2-4-9-18/h2-17,27H,1H3/b29-28+
InChIKeyZHVAIPDUVJOZBF-ZQHSETAFSA-N
XLogP6.84
TPSA49.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500376.46
LogP ≤ 56.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}

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Related Compounds

2-Aminoquinoline
CID 11379
5-Phenethylquinazoline-2,4-diamine
CID 490662
N~2~-(3,4-dimethylphenyl)-2,4-quinazolinediamine hydrochloride
CID 2975866
6-(4-Methyl-piperazin-1-yl)-phenanthridine
CID 9993659
N,2-diphenylquinazolin-4-amine
CID 698960
Quinazoline, 2,4-dianilino-
CID 213847
4-Methylquinolin-2-amine
CID 231935
6-Aminophenanthridine
CID 160547
7-[[2-(3-Fluorophenyl)ethylamino]methyl]quinolin-2-Amine
CID 72771077
7-{2-[(3-Fluorobenzyl)amino]ethyl}quinolin-2-Amine
CID 72771078
7-[2-[3-(3-Fluorophenyl)propylamino]ethyl]quinolin-2-Amine
CID 72771079
7-({[3-(3-Fluorophenyl)propyl]amino}methyl)quinolin-2-Amine
CID 72771080

Frequently Asked Questions

What is the IUPAC name of (2-methyl-5-phenyl-1H-quinolin-2-yl)-quinolin-2-yldiazene?
The IUPAC name of (2-methyl-5-phenyl-1H-quinolin-2-yl)-quinolin-2-yldiazene (CID 155818085) is (2-methyl-5-phenyl-1H-quinolin-2-yl)-quinolin-2-yldiazene.
What is the SMILES notation for (2-methyl-5-phenyl-1H-quinolin-2-yl)-quinolin-2-yldiazene?
The canonical SMILES for (2-methyl-5-phenyl-1H-quinolin-2-yl)-quinolin-2-yldiazene is CC1(/N=N/c2ccc3ccccc3n2)C=Cc2c(cccc2-c2ccccc2)N1.
What is the InChIKey of (2-methyl-5-phenyl-1H-quinolin-2-yl)-quinolin-2-yldiazene?
The InChIKey is ZHVAIPDUVJOZBF-ZQHSETAFSA-N. The full InChI is InChI=1S/C25H20N4/c1-25(29-28-24-15-14-19-10-5-6-12-22(19)26-24)17-16-21-20(11-7-13-23(21)27-25)18-8-3-2-4-9-18/h2-17,27H,1H3/b29-28+.
What are the key properties of (2-methyl-5-phenyl-1H-quinolin-2-yl)-quinolin-2-yldiazene?
(2-methyl-5-phenyl-1H-quinolin-2-yl)-quinolin-2-yldiazene has a molecular weight of 376.46 g/mol, XLogP of 6.84, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methyl-5-phenyl-1H-quinolin-2-yl)-quinolin-2-yldiazene is sourced from PubChem (CID 155818085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).