2-methoxy-6-(quinolin-8-yliminomethyl)phenol

C17H14N2O2 — CID 135758483

IUPAC2-methoxy-6-(quinolin-8-yliminomethyl)phenol
SMILESCOc1cccc(/C=N/c2cccc3cccnc23)c1O
InChIInChI=1S/C17H14N2O2/c1-21-15-9-3-6-13(17(15)20)11-19-14-8-2-5-12-7-4-10-18-16(12)14/h2-11,20H,1H3/b19-11+
InChIKeyWQILJOHXDDQXPC-YBFXNURJSA-N
MW278.31 g/mol
LogP3.70
Rot. Bonds3

About 2-methoxy-6-(quinolin-8-yliminomethyl)phenol

2-methoxy-6-(quinolin-8-yliminomethyl)phenol (PubChem CID 135758483) has the molecular formula C17H14N2O2 and a molecular weight of 278.31 g/mol. Its IUPAC name is 2-methoxy-6-(quinolin-8-yliminomethyl)phenol.

Molecular Properties

Compound Name2-methoxy-6-(quinolin-8-yliminomethyl)phenol
PubChem CID135758483
Molecular FormulaC17H14N2O2
Molecular Weight278.31 g/mol
Exact Mass278.11
IUPAC Name2-methoxy-6-(quinolin-8-yliminomethyl)phenol
SMILESCOc1cccc(/C=N/c2cccc3cccnc23)c1O
InChIInChI=1S/C17H14N2O2/c1-21-15-9-3-6-13(17(15)20)11-19-14-8-2-5-12-7-4-10-18-16(12)14/h2-11,20H,1H3/b19-11+
InChIKeyWQILJOHXDDQXPC-YBFXNURJSA-N
XLogP3.70
TPSA54.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.31
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-6-(quinolin-8-yliminomethyl)phenol?
The IUPAC name of 2-methoxy-6-(quinolin-8-yliminomethyl)phenol (CID 135758483) is 2-methoxy-6-(quinolin-8-yliminomethyl)phenol.
What is the SMILES notation for 2-methoxy-6-(quinolin-8-yliminomethyl)phenol?
The canonical SMILES for 2-methoxy-6-(quinolin-8-yliminomethyl)phenol is COc1cccc(/C=N/c2cccc3cccnc23)c1O.
What is the InChIKey of 2-methoxy-6-(quinolin-8-yliminomethyl)phenol?
The InChIKey is WQILJOHXDDQXPC-YBFXNURJSA-N. The full InChI is InChI=1S/C17H14N2O2/c1-21-15-9-3-6-13(17(15)20)11-19-14-8-2-5-12-7-4-10-18-16(12)14/h2-11,20H,1H3/b19-11+.
What are the key properties of 2-methoxy-6-(quinolin-8-yliminomethyl)phenol?
2-methoxy-6-(quinolin-8-yliminomethyl)phenol has a molecular weight of 278.31 g/mol, XLogP of 3.70, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-6-(quinolin-8-yliminomethyl)phenol is sourced from PubChem (CID 135758483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).