[3-diazenyl-2-(naphthalen-2-yldiazenyl)phenyl]-pyridin-2-yldiazene

C21H15N7 — CID 54379660

IUPAC[3-diazenyl-2-(naphthalen-2-yldiazenyl)phenyl]-pyridin-2-yldiazene
SMILES[H]/N=N/c1cccc(/N=N/c2ccccn2)c1/N=N/c1ccc2ccccc2c1
InChIInChI=1S/C21H15N7/c22-24-18-8-5-9-19(26-27-20-10-3-4-13-23-20)21(18)28-25-17-12-11-15-6-1-2-7-16(15)14-17/h1-14,22H/b24-22+,27-26+,28-25+
InChIKeyZRASDNMZGZSFGT-HTHVAWEESA-N
MW365.40 g/mol
LogP7.73
Rot. Bonds5

About [3-diazenyl-2-(naphthalen-2-yldiazenyl)phenyl]-pyridin-2-yldiazene

[3-diazenyl-2-(naphthalen-2-yldiazenyl)phenyl]-pyridin-2-yldiazene (PubChem CID 54379660) has the molecular formula C21H15N7 and a molecular weight of 365.40 g/mol. Its IUPAC name is [3-diazenyl-2-(naphthalen-2-yldiazenyl)phenyl]-pyridin-2-yldiazene.

Molecular Properties

Compound Name[3-diazenyl-2-(naphthalen-2-yldiazenyl)phenyl]-pyridin-2-yldiazene
PubChem CID54379660
Molecular FormulaC21H15N7
Molecular Weight365.40 g/mol
Exact Mass365.14
IUPAC Name[3-diazenyl-2-(naphthalen-2-yldiazenyl)phenyl]-pyridin-2-yldiazene
SMILES[H]/N=N/c1cccc(/N=N/c2ccccn2)c1/N=N/c1ccc2ccccc2c1
InChIInChI=1S/C21H15N7/c22-24-18-8-5-9-19(26-27-20-10-3-4-13-23-20)21(18)28-25-17-12-11-15-6-1-2-7-16(15)14-17/h1-14,22H/b24-22+,27-26+,28-25+
InChIKeyZRASDNMZGZSFGT-HTHVAWEESA-N
XLogP7.73
TPSA98.54 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500365.40
LogP ≤ 57.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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

naphthalen-1-yl-[3-[4-(pyridin-2-yldiazenyl)phenyl]phenyl]diazene
CID 173000934
dipyridin-2-yldiazene;osmium
CID 173074203
(4-diazenyl-3-methylphenyl)-(2-methylphenyl)diazene
CID 4196526
(2,6-dichlorophenyl)-pyridin-2-yldiazene
CID 102225413
(2-ethoxyphenyl)-pyridin-2-yldiazene
CID 122538186
N,N-dimethyl-4-(pyridin-2-yldiazenyl)benzeneamine oxide
CID 102057168
5-(dimethylamino)-2-(pyridin-2-yldiazenyl)phenolate
CID 172638148
(4-methoxyphenyl)-naphthalen-2-yldiazene
CID 572318
naphthalen-2-yl-[6-[2-[6-(naphthalen-2-yldiazenyl)naphthalen-2-yl]ethenyl]naphthalen-2-yl]diazene
CID 72565674
disodium;4-(pyridin-2-yldiazenyl)benzene-1,3-diolate;dihydrate
CID 2735125
5,17-bis(naphthalen-2-yldiazenyl)-2,8,14,20-tetrathiapentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(25),3,5,7(28),9(27),10,12,15(26),16,18,21,23-dodecaene-25,26,27,28-tetrol
CID 136834916
4-(pyridin-2-yldiazenyl)benzene-1,3-diol;titanium(4+)
CID 158518155

Frequently Asked Questions

What is the IUPAC name of [3-diazenyl-2-(naphthalen-2-yldiazenyl)phenyl]-pyridin-2-yldiazene?
The IUPAC name of [3-diazenyl-2-(naphthalen-2-yldiazenyl)phenyl]-pyridin-2-yldiazene (CID 54379660) is [3-diazenyl-2-(naphthalen-2-yldiazenyl)phenyl]-pyridin-2-yldiazene.
What is the SMILES notation for [3-diazenyl-2-(naphthalen-2-yldiazenyl)phenyl]-pyridin-2-yldiazene?
The canonical SMILES for [3-diazenyl-2-(naphthalen-2-yldiazenyl)phenyl]-pyridin-2-yldiazene is [H]/N=N/c1cccc(/N=N/c2ccccn2)c1/N=N/c1ccc2ccccc2c1.
What is the InChIKey of [3-diazenyl-2-(naphthalen-2-yldiazenyl)phenyl]-pyridin-2-yldiazene?
The InChIKey is ZRASDNMZGZSFGT-HTHVAWEESA-N. The full InChI is InChI=1S/C21H15N7/c22-24-18-8-5-9-19(26-27-20-10-3-4-13-23-20)21(18)28-25-17-12-11-15-6-1-2-7-16(15)14-17/h1-14,22H/b24-22+,27-26+,28-25+.
What are the key properties of [3-diazenyl-2-(naphthalen-2-yldiazenyl)phenyl]-pyridin-2-yldiazene?
[3-diazenyl-2-(naphthalen-2-yldiazenyl)phenyl]-pyridin-2-yldiazene has a molecular weight of 365.40 g/mol, XLogP of 7.73, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [3-diazenyl-2-(naphthalen-2-yldiazenyl)phenyl]-pyridin-2-yldiazene is sourced from PubChem (CID 54379660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).