5-[(2-methylphenyl)diazenyl]quinolin-8-ol

C16H13N3O — CID 135517005

IUPAC5-[(2-methylphenyl)diazenyl]quinolin-8-ol
SMILESCc1ccccc1/N=N/c1ccc(O)c2ncccc12
InChIInChI=1S/C16H13N3O/c1-11-5-2-3-7-13(11)18-19-14-8-9-15(20)16-12(14)6-4-10-17-16/h2-10,20H,1H3/b19-18+
InChIKeyAWCWBBFCPBMIAW-VHEBQXMUSA-N
MW263.30 g/mol
LogP4.66
Rot. Bonds2

About 5-[(2-methylphenyl)diazenyl]quinolin-8-ol

5-[(2-methylphenyl)diazenyl]quinolin-8-ol (PubChem CID 135517005) has the molecular formula C16H13N3O and a molecular weight of 263.30 g/mol. Its IUPAC name is 5-[(2-methylphenyl)diazenyl]quinolin-8-ol.

Molecular Properties

Compound Name5-[(2-methylphenyl)diazenyl]quinolin-8-ol
PubChem CID135517005
Molecular FormulaC16H13N3O
Molecular Weight263.30 g/mol
Exact Mass263.11
IUPAC Name5-[(2-methylphenyl)diazenyl]quinolin-8-ol
SMILESCc1ccccc1/N=N/c1ccc(O)c2ncccc12
InChIInChI=1S/C16H13N3O/c1-11-5-2-3-7-13(11)18-19-14-8-9-15(20)16-12(14)6-4-10-17-16/h2-10,20H,1H3/b19-18+
InChIKeyAWCWBBFCPBMIAW-VHEBQXMUSA-N
XLogP4.66
TPSA57.84 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.30
LogP ≤ 54.66
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

8-Hydroxyquinoline
CID 1923
5,7-Diiodo-8-hydroxyquinoline
CID 3728
Nitroxoline
CID 19910
Oxine-copper
CID 3032555
5-Nitroso-8-quinolinol
CID 19103
Hydroxyquinoline sulfate
CID 517000
5-Methyl-8-hydroxyquinoline
CID 71208
2-Methyl-8-hydroxyquinoline
CID 13224
8-Hydroxyquinoline N-oxide
CID 14312
5-Amino-8-hydroxyquinoline
CID 416002
5-(N-methyl-N-propargylaminomethyl)-8-hydroxyquinoline
CID 6918822
3-Hydroxyquinoline
CID 11376

Frequently Asked Questions

What is the IUPAC name of 5-[(2-methylphenyl)diazenyl]quinolin-8-ol?
The IUPAC name of 5-[(2-methylphenyl)diazenyl]quinolin-8-ol (CID 135517005) is 5-[(2-methylphenyl)diazenyl]quinolin-8-ol.
What is the SMILES notation for 5-[(2-methylphenyl)diazenyl]quinolin-8-ol?
The canonical SMILES for 5-[(2-methylphenyl)diazenyl]quinolin-8-ol is Cc1ccccc1/N=N/c1ccc(O)c2ncccc12.
What is the InChIKey of 5-[(2-methylphenyl)diazenyl]quinolin-8-ol?
The InChIKey is AWCWBBFCPBMIAW-VHEBQXMUSA-N. The full InChI is InChI=1S/C16H13N3O/c1-11-5-2-3-7-13(11)18-19-14-8-9-15(20)16-12(14)6-4-10-17-16/h2-10,20H,1H3/b19-18+.
What are the key properties of 5-[(2-methylphenyl)diazenyl]quinolin-8-ol?
5-[(2-methylphenyl)diazenyl]quinolin-8-ol has a molecular weight of 263.30 g/mol, XLogP of 4.66, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2-methylphenyl)diazenyl]quinolin-8-ol is sourced from PubChem (CID 135517005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).