N-(4-methylphenyl)-2-(pyridin-2-yldiazenyl)aniline

C18H16N4 — CID 15443301

IUPACN-(4-methylphenyl)-2-(pyridin-2-yldiazenyl)aniline
SMILESCc1ccc(Nc2ccccc2/N=N/c2ccccn2)cc1
InChIInChI=1S/C18H16N4/c1-14-9-11-15(12-10-14)20-16-6-2-3-7-17(16)21-22-18-8-4-5-13-19-18/h2-13,20H,1H3/b22-21+
InChIKeyFZBFBFCGADHTRK-QURGRASLSA-N
MW288.35 g/mol
LogP5.55
Rot. Bonds4

About N-(4-methylphenyl)-2-(pyridin-2-yldiazenyl)aniline

N-(4-methylphenyl)-2-(pyridin-2-yldiazenyl)aniline (PubChem CID 15443301) has the molecular formula C18H16N4 and a molecular weight of 288.35 g/mol. Its IUPAC name is N-(4-methylphenyl)-2-(pyridin-2-yldiazenyl)aniline.

Molecular Properties

Compound NameN-(4-methylphenyl)-2-(pyridin-2-yldiazenyl)aniline
PubChem CID15443301
Molecular FormulaC18H16N4
Molecular Weight288.35 g/mol
Exact Mass288.14
IUPAC NameN-(4-methylphenyl)-2-(pyridin-2-yldiazenyl)aniline
SMILESCc1ccc(Nc2ccccc2/N=N/c2ccccn2)cc1
InChIInChI=1S/C18H16N4/c1-14-9-11-15(12-10-14)20-16-6-2-3-7-17(16)21-22-18-8-4-5-13-19-18/h2-13,20H,1H3/b22-21+
InChIKeyFZBFBFCGADHTRK-QURGRASLSA-N
XLogP5.55
TPSA49.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500288.35
LogP ≤ 55.55
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

1-N-(4-methylphenyl)-2-N-pyrimidin-2-ylbenzene-1,2-diamine
CID 108778175
N-[2-(4-methylanilino)phenyl]pyridine-2-carboxamide
CID 108745005
dipyridin-2-yldiazene;osmium
CID 173074203
nickel;4-[[8-(pyridin-2-yldiazenyl)quinolin-5-yl]amino]benzoic acid
CID 162103797
(2-ethoxyphenyl)-pyridin-2-yldiazene
CID 122538186
1-(4-methylphenyl)-2,3-dipyridin-2-ylguanidine
CID 24939669
dicopper;bis(N-(4-methylphenyl)pyridin-2-amine);tetraacetate
CID 139082295
2-(4-methylanilino)cyclohepta-2,4,6-trien-1-one
CID 658410
1-N,4-N-bis(4-methylphenyl)-2,3-diphenylbenzene-1,4-diamine
CID 146472249
N-(2-nitrosophenyl)pyridin-2-amine
CID 22903582
1-N,4-N-dipyridin-2-ylbenzene-1,4-diamine
CID 139175237
2-[(2,6-dimethylphenyl)iminomethyl]-N-(4-methylphenyl)aniline
CID 102395036

Frequently Asked Questions

What is the IUPAC name of N-(4-methylphenyl)-2-(pyridin-2-yldiazenyl)aniline?
The IUPAC name of N-(4-methylphenyl)-2-(pyridin-2-yldiazenyl)aniline (CID 15443301) is N-(4-methylphenyl)-2-(pyridin-2-yldiazenyl)aniline.
What is the SMILES notation for N-(4-methylphenyl)-2-(pyridin-2-yldiazenyl)aniline?
The canonical SMILES for N-(4-methylphenyl)-2-(pyridin-2-yldiazenyl)aniline is Cc1ccc(Nc2ccccc2/N=N/c2ccccn2)cc1.
What is the InChIKey of N-(4-methylphenyl)-2-(pyridin-2-yldiazenyl)aniline?
The InChIKey is FZBFBFCGADHTRK-QURGRASLSA-N. The full InChI is InChI=1S/C18H16N4/c1-14-9-11-15(12-10-14)20-16-6-2-3-7-17(16)21-22-18-8-4-5-13-19-18/h2-13,20H,1H3/b22-21+.
What are the key properties of N-(4-methylphenyl)-2-(pyridin-2-yldiazenyl)aniline?
N-(4-methylphenyl)-2-(pyridin-2-yldiazenyl)aniline has a molecular weight of 288.35 g/mol, XLogP of 5.55, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methylphenyl)-2-(pyridin-2-yldiazenyl)aniline is sourced from PubChem (CID 15443301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).