2-[(E)-(quinolin-8-ylhydrazinylidene)methyl]quinolin-8-ol

C19H14N4O — CID 135428109

IUPAC2-[(E)-(quinolin-8-ylhydrazinylidene)methyl]quinolin-8-ol
SMILESOc1cccc2ccc(/C=N/Nc3cccc4cccnc34)nc12
InChIInChI=1S/C19H14N4O/c24-17-8-2-5-14-9-10-15(22-19(14)17)12-21-23-16-7-1-4-13-6-3-11-20-18(13)16/h1-12,23-24H/b21-12+
InChIKeyMVRYUWHNRSHURE-CIAFOILYSA-N
MW314.35 g/mol
LogP3.93
Rot. Bonds3

About 2-[(E)-(quinolin-8-ylhydrazinylidene)methyl]quinolin-8-ol

2-[(E)-(quinolin-8-ylhydrazinylidene)methyl]quinolin-8-ol (PubChem CID 135428109) has the molecular formula C19H14N4O and a molecular weight of 314.35 g/mol. Its IUPAC name is 2-[(E)-(quinolin-8-ylhydrazinylidene)methyl]quinolin-8-ol.

Molecular Properties

Compound Name2-[(E)-(quinolin-8-ylhydrazinylidene)methyl]quinolin-8-ol
PubChem CID135428109
Molecular FormulaC19H14N4O
Molecular Weight314.35 g/mol
Exact Mass314.12
IUPAC Name2-[(E)-(quinolin-8-ylhydrazinylidene)methyl]quinolin-8-ol
SMILESOc1cccc2ccc(/C=N/Nc3cccc4cccnc34)nc12
InChIInChI=1S/C19H14N4O/c24-17-8-2-5-14-9-10-15(22-19(14)17)12-21-23-16-7-1-4-13-6-3-11-20-18(13)16/h1-12,23-24H/b21-12+
InChIKeyMVRYUWHNRSHURE-CIAFOILYSA-N
XLogP3.93
TPSA70.40 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.35
LogP ≤ 53.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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)-(quinolin-8-ylhydrazinylidene)methyl]quinolin-8-ol?
The IUPAC name of 2-[(E)-(quinolin-8-ylhydrazinylidene)methyl]quinolin-8-ol (CID 135428109) is 2-[(E)-(quinolin-8-ylhydrazinylidene)methyl]quinolin-8-ol.
What is the SMILES notation for 2-[(E)-(quinolin-8-ylhydrazinylidene)methyl]quinolin-8-ol?
The canonical SMILES for 2-[(E)-(quinolin-8-ylhydrazinylidene)methyl]quinolin-8-ol is Oc1cccc2ccc(/C=N/Nc3cccc4cccnc34)nc12.
What is the InChIKey of 2-[(E)-(quinolin-8-ylhydrazinylidene)methyl]quinolin-8-ol?
The InChIKey is MVRYUWHNRSHURE-CIAFOILYSA-N. The full InChI is InChI=1S/C19H14N4O/c24-17-8-2-5-14-9-10-15(22-19(14)17)12-21-23-16-7-1-4-13-6-3-11-20-18(13)16/h1-12,23-24H/b21-12+.
What are the key properties of 2-[(E)-(quinolin-8-ylhydrazinylidene)methyl]quinolin-8-ol?
2-[(E)-(quinolin-8-ylhydrazinylidene)methyl]quinolin-8-ol has a molecular weight of 314.35 g/mol, XLogP of 3.93, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(E)-(quinolin-8-ylhydrazinylidene)methyl]quinolin-8-ol is sourced from PubChem (CID 135428109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).