2-[(E)-[(E)-(8-hydroxyquinolin-2-yl)methylidenehydrazinylidene]methyl]quinolin-8-ol

C20H14N4O2 — CID 135472364

IUPAC2-[(E)-[(E)-(8-hydroxyquinolin-2-yl)methylidenehydrazinylidene]methyl]quinolin-8-ol
SMILESOc1cccc2ccc(/C=N/N=C/c3ccc4cccc(O)c4n3)nc12
InChIInChI=1S/C20H14N4O2/c25-17-5-1-3-13-7-9-15(23-19(13)17)11-21-22-12-16-10-8-14-4-2-6-18(26)20(14)24-16/h1-12,25-26H/b21-11+,22-12+
InChIKeyYHMATFVKGDTTQB-XHQRYOPUSA-N
MW342.36 g/mol
LogP3.65
Rot. Bonds3

About 2-[(E)-[(E)-(8-hydroxyquinolin-2-yl)methylidenehydrazinylidene]methyl]quinolin-8-ol

2-[(E)-[(E)-(8-hydroxyquinolin-2-yl)methylidenehydrazinylidene]methyl]quinolin-8-ol (PubChem CID 135472364) has the molecular formula C20H14N4O2 and a molecular weight of 342.36 g/mol. Its IUPAC name is 2-[(E)-[(E)-(8-hydroxyquinolin-2-yl)methylidenehydrazinylidene]methyl]quinolin-8-ol.

Molecular Properties

Compound Name2-[(E)-[(E)-(8-hydroxyquinolin-2-yl)methylidenehydrazinylidene]methyl]quinolin-8-ol
PubChem CID135472364
Molecular FormulaC20H14N4O2
Molecular Weight342.36 g/mol
Exact Mass342.11
IUPAC Name2-[(E)-[(E)-(8-hydroxyquinolin-2-yl)methylidenehydrazinylidene]methyl]quinolin-8-ol
SMILESOc1cccc2ccc(/C=N/N=C/c3ccc4cccc(O)c4n3)nc12
InChIInChI=1S/C20H14N4O2/c25-17-5-1-3-13-7-9-15(23-19(13)17)11-21-22-12-16-10-8-14-4-2-6-18(26)20(14)24-16/h1-12,25-26H/b21-11+,22-12+
InChIKeyYHMATFVKGDTTQB-XHQRYOPUSA-N
XLogP3.65
TPSA90.96 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.36
LogP ≤ 53.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-[(E)-[(E)-(8-hydroxyquinolin-2-yl)methylidenehydrazinylidene]methyl]quinolin-8-ol?
The IUPAC name of 2-[(E)-[(E)-(8-hydroxyquinolin-2-yl)methylidenehydrazinylidene]methyl]quinolin-8-ol (CID 135472364) is 2-[(E)-[(E)-(8-hydroxyquinolin-2-yl)methylidenehydrazinylidene]methyl]quinolin-8-ol.
What is the SMILES notation for 2-[(E)-[(E)-(8-hydroxyquinolin-2-yl)methylidenehydrazinylidene]methyl]quinolin-8-ol?
The canonical SMILES for 2-[(E)-[(E)-(8-hydroxyquinolin-2-yl)methylidenehydrazinylidene]methyl]quinolin-8-ol is Oc1cccc2ccc(/C=N/N=C/c3ccc4cccc(O)c4n3)nc12.
What is the InChIKey of 2-[(E)-[(E)-(8-hydroxyquinolin-2-yl)methylidenehydrazinylidene]methyl]quinolin-8-ol?
The InChIKey is YHMATFVKGDTTQB-XHQRYOPUSA-N. The full InChI is InChI=1S/C20H14N4O2/c25-17-5-1-3-13-7-9-15(23-19(13)17)11-21-22-12-16-10-8-14-4-2-6-18(26)20(14)24-16/h1-12,25-26H/b21-11+,22-12+.
What are the key properties of 2-[(E)-[(E)-(8-hydroxyquinolin-2-yl)methylidenehydrazinylidene]methyl]quinolin-8-ol?
2-[(E)-[(E)-(8-hydroxyquinolin-2-yl)methylidenehydrazinylidene]methyl]quinolin-8-ol has a molecular weight of 342.36 g/mol, XLogP of 3.65, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(E)-[(E)-(8-hydroxyquinolin-2-yl)methylidenehydrazinylidene]methyl]quinolin-8-ol is sourced from PubChem (CID 135472364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).