4-methyl-2-[(3-methyl-2-pyridinyl)diazenyl]naphthalen-1-ol

C17H15N3O — CID 136662692

IUPAC4-methyl-2-[(3-methyl-2-pyridinyl)diazenyl]naphthalen-1-ol
SMILESCc1cccnc1/N=N/c1cc(C)c2ccccc2c1O
InChIInChI=1S/C17H15N3O/c1-11-6-5-9-18-17(11)20-19-15-10-12(2)13-7-3-4-8-14(13)16(15)21/h3-10,21H,1-2H3/b20-19+
InChIKeyZQJHDUBNKVJRMD-FMQUCBEESA-N
MW277.33 g/mol
LogP4.97
Rot. Bonds2

About 4-methyl-2-[(3-methyl-2-pyridinyl)diazenyl]naphthalen-1-ol

4-methyl-2-[(3-methyl-2-pyridinyl)diazenyl]naphthalen-1-ol (PubChem CID 136662692) has the molecular formula C17H15N3O and a molecular weight of 277.33 g/mol. Its IUPAC name is 4-methyl-2-[(3-methyl-2-pyridinyl)diazenyl]naphthalen-1-ol.

Molecular Properties

Compound Name4-methyl-2-[(3-methyl-2-pyridinyl)diazenyl]naphthalen-1-ol
PubChem CID136662692
Molecular FormulaC17H15N3O
Molecular Weight277.33 g/mol
Exact Mass277.12
IUPAC Name4-methyl-2-[(3-methyl-2-pyridinyl)diazenyl]naphthalen-1-ol
SMILESCc1cccnc1/N=N/c1cc(C)c2ccccc2c1O
InChIInChI=1S/C17H15N3O/c1-11-6-5-9-18-17(11)20-19-15-10-12(2)13-7-3-4-8-14(13)16(15)21/h3-10,21H,1-2H3/b20-19+
InChIKeyZQJHDUBNKVJRMD-FMQUCBEESA-N
XLogP4.97
TPSA57.84 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.33
LogP ≤ 54.97
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-(2-Pyridylazo)-1-naphthol
CID 2831996
1-(2-Pyridylazo)-2-naphthol
CID 6825
1-[[(4-Methylpyridin-2-yl)amino]methyl]naphthalen-2-ol
CID 890718
1-[(Pyridin-2-ylhydrazinylidene)methyl]naphthalen-2-ol
CID 263867
1-(4-Methyl-2-pyridyliminomethyl)-2-naphthol
CID 809927
1-[(Pyridin-2-ylamino)methyl]naphthalen-2-ol
CID 759948
4-[2-Amino-5-[3-(dimethylamino) phenyl]-3-pyridyl]phenol
CID 24821076
4-[6-Amino-5-[4-(4-methylpiperazin-1-yl)phenyl]-3-pyridinyl]-2,6-dimethylphenol
CID 44525554
2-Naphthalenol, 1-(2-(3-pyridinyl)diazenyl)-
CID 73745
1-(2-Pyridyliminomethyl)-2-naphthol
CID 556235
2-(2-Hydroxy-1-naphthylmethyleneamino)-3-methylpyridine
CID 810225
1-{(E)-[(5-chloropyridin-2-yl)imino]methyl}-2-naphthol
CID 710273

Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-[(3-methyl-2-pyridinyl)diazenyl]naphthalen-1-ol?
The IUPAC name of 4-methyl-2-[(3-methyl-2-pyridinyl)diazenyl]naphthalen-1-ol (CID 136662692) is 4-methyl-2-[(3-methyl-2-pyridinyl)diazenyl]naphthalen-1-ol.
What is the SMILES notation for 4-methyl-2-[(3-methyl-2-pyridinyl)diazenyl]naphthalen-1-ol?
The canonical SMILES for 4-methyl-2-[(3-methyl-2-pyridinyl)diazenyl]naphthalen-1-ol is Cc1cccnc1/N=N/c1cc(C)c2ccccc2c1O.
What is the InChIKey of 4-methyl-2-[(3-methyl-2-pyridinyl)diazenyl]naphthalen-1-ol?
The InChIKey is ZQJHDUBNKVJRMD-FMQUCBEESA-N. The full InChI is InChI=1S/C17H15N3O/c1-11-6-5-9-18-17(11)20-19-15-10-12(2)13-7-3-4-8-14(13)16(15)21/h3-10,21H,1-2H3/b20-19+.
What are the key properties of 4-methyl-2-[(3-methyl-2-pyridinyl)diazenyl]naphthalen-1-ol?
4-methyl-2-[(3-methyl-2-pyridinyl)diazenyl]naphthalen-1-ol has a molecular weight of 277.33 g/mol, XLogP of 4.97, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-[(3-methyl-2-pyridinyl)diazenyl]naphthalen-1-ol is sourced from PubChem (CID 136662692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).