2-[[2-hydroxy-4-[[4-[[4-(methyldiazenyl)phenyl]diazenyl]phenyl]diazenyl]phenyl]diazenyl]-6-methylnaphthalen-1-ol

C30H24N8O2 — CID 137279923

IUPAC2-[[2-hydroxy-4-[[4-[[4-(methyldiazenyl)phenyl]diazenyl]phenyl]diazenyl]phenyl]diazenyl]-6-methylnaphthalen-1-ol
SMILESC/N=N/c1ccc(/N=N/c2ccc(/N=N/c3ccc(/N=N/c4ccc5cc(C)ccc5c4O)c(O)c3)cc2)cc1
InChIInChI=1S/C30H24N8O2/c1-19-3-14-26-20(17-19)4-15-28(30(26)40)38-37-27-16-13-25(18-29(27)39)36-35-24-11-9-23(10-12-24)34-33-22-7-5-21(6-8-22)32-31-2/h3-18,39-40H,1-2H3/b32-31+,34-33+,36-35+,38-37+
InChIKeyYRIAYGYBEVUWQB-HNISISPFSA-N
MW528.58 g/mol
LogP10.52
Rot. Bonds7

About 2-[[2-hydroxy-4-[[4-[[4-(methyldiazenyl)phenyl]diazenyl]phenyl]diazenyl]phenyl]diazenyl]-6-methylnaphthalen-1-ol

2-[[2-hydroxy-4-[[4-[[4-(methyldiazenyl)phenyl]diazenyl]phenyl]diazenyl]phenyl]diazenyl]-6-methylnaphthalen-1-ol (PubChem CID 137279923) has the molecular formula C30H24N8O2 and a molecular weight of 528.58 g/mol. Its IUPAC name is 2-[[2-hydroxy-4-[[4-[[4-(methyldiazenyl)phenyl]diazenyl]phenyl]diazenyl]phenyl]diazenyl]-6-methylnaphthalen-1-ol.

Molecular Properties

Compound Name2-[[2-hydroxy-4-[[4-[[4-(methyldiazenyl)phenyl]diazenyl]phenyl]diazenyl]phenyl]diazenyl]-6-methylnaphthalen-1-ol
PubChem CID137279923
Molecular FormulaC30H24N8O2
Molecular Weight528.58 g/mol
Exact Mass528.20
IUPAC Name2-[[2-hydroxy-4-[[4-[[4-(methyldiazenyl)phenyl]diazenyl]phenyl]diazenyl]phenyl]diazenyl]-6-methylnaphthalen-1-ol
SMILESC/N=N/c1ccc(/N=N/c2ccc(/N=N/c3ccc(/N=N/c4ccc5cc(C)ccc5c4O)c(O)c3)cc2)cc1
InChIInChI=1S/C30H24N8O2/c1-19-3-14-26-20(17-19)4-15-28(30(26)40)38-37-27-16-13-25(18-29(27)39)36-35-24-11-9-23(10-12-24)34-33-22-7-5-21(6-8-22)32-31-2/h3-18,39-40H,1-2H3/b32-31+,34-33+,36-35+,38-37+
InChIKeyYRIAYGYBEVUWQB-HNISISPFSA-N
XLogP10.52
TPSA139.34 Ų
H-Bond Donors2
H-Bond Acceptors10
Rotatable Bonds7
Heavy Atoms40
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500528.58
LogP ≤ 510.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1010

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

copper;2-[[2-hydroxy-4-(methyldiazenyl)phenyl]diazenyl]-6-methylnaphthalen-1-ol;methoxymethane;sulfur trioxide
CID 159809926
6-methyl-2-[(4-methylphenyl)diazenyl]naphthalen-1-ol
CID 136606671
CID 159135966
CID 159135966
5-methyl-2-[(4-methylphenyl)diazenyl]phenol
CID 135467997
6-methyl-1-phenyldiazenylnaphthalen-2-ol
CID 135829765
1-[[4-[(6,8-dimethylnaphthalen-2-yl)diazenyl]naphthalen-1-yl]diazenyl]-3,6-dimethylnaphthalen-2-ol
CID 135597564
2-[(2-aminonaphthalen-1-yl)diazenyl]-5-methylphenol
CID 154145650
4-methyl-2-[(4-phenyldiazenylphenyl)diazenyl]phenol
CID 3519903
6-methylnaphthalene-1,2,3-triol
CID 22497955
2-[(2-hydroxyphenyl)diazenyl]naphthalen-1-ol
CID 135744709
7-amino-2-[(4-aminophenyl)diazenyl]naphthalen-1-ol
CID 175748913
2-[(4-methoxyphenyl)diazenyl]naphthalene-1,5-diol
CID 137230625

Frequently Asked Questions

What is the IUPAC name of 2-[[2-hydroxy-4-[[4-[[4-(methyldiazenyl)phenyl]diazenyl]phenyl]diazenyl]phenyl]diazenyl]-6-methylnaphthalen-1-ol?
The IUPAC name of 2-[[2-hydroxy-4-[[4-[[4-(methyldiazenyl)phenyl]diazenyl]phenyl]diazenyl]phenyl]diazenyl]-6-methylnaphthalen-1-ol (CID 137279923) is 2-[[2-hydroxy-4-[[4-[[4-(methyldiazenyl)phenyl]diazenyl]phenyl]diazenyl]phenyl]diazenyl]-6-methylnaphthalen-1-ol.
What is the SMILES notation for 2-[[2-hydroxy-4-[[4-[[4-(methyldiazenyl)phenyl]diazenyl]phenyl]diazenyl]phenyl]diazenyl]-6-methylnaphthalen-1-ol?
The canonical SMILES for 2-[[2-hydroxy-4-[[4-[[4-(methyldiazenyl)phenyl]diazenyl]phenyl]diazenyl]phenyl]diazenyl]-6-methylnaphthalen-1-ol is C/N=N/c1ccc(/N=N/c2ccc(/N=N/c3ccc(/N=N/c4ccc5cc(C)ccc5c4O)c(O)c3)cc2)cc1.
What is the InChIKey of 2-[[2-hydroxy-4-[[4-[[4-(methyldiazenyl)phenyl]diazenyl]phenyl]diazenyl]phenyl]diazenyl]-6-methylnaphthalen-1-ol?
The InChIKey is YRIAYGYBEVUWQB-HNISISPFSA-N. The full InChI is InChI=1S/C30H24N8O2/c1-19-3-14-26-20(17-19)4-15-28(30(26)40)38-37-27-16-13-25(18-29(27)39)36-35-24-11-9-23(10-12-24)34-33-22-7-5-21(6-8-22)32-31-2/h3-18,39-40H,1-2H3/b32-31+,34-33+,36-35+,38-37+.
What are the key properties of 2-[[2-hydroxy-4-[[4-[[4-(methyldiazenyl)phenyl]diazenyl]phenyl]diazenyl]phenyl]diazenyl]-6-methylnaphthalen-1-ol?
2-[[2-hydroxy-4-[[4-[[4-(methyldiazenyl)phenyl]diazenyl]phenyl]diazenyl]phenyl]diazenyl]-6-methylnaphthalen-1-ol has a molecular weight of 528.58 g/mol, XLogP of 10.52, 7 rotatable bonds, 2 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-hydroxy-4-[[4-[[4-(methyldiazenyl)phenyl]diazenyl]phenyl]diazenyl]phenyl]diazenyl]-6-methylnaphthalen-1-ol is sourced from PubChem (CID 137279923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).