6-(methoxymethoxy)-2-[(E)-2-(2-methoxy-4-pyridinyl)ethenyl]quinoline

C19H18N2O3 — CID 130185200

IUPAC6-(methoxymethoxy)-2-[(E)-2-(2-methoxy-4-pyridinyl)ethenyl]quinoline
SMILESCOCOc1ccc2nc(/C=C/c3ccnc(OC)c3)ccc2c1
InChIInChI=1S/C19H18N2O3/c1-22-13-24-17-7-8-18-15(12-17)4-6-16(21-18)5-3-14-9-10-20-19(11-14)23-2/h3-12H,13H2,1-2H3/b5-3+
InChIKeyGLPRKMPLQZOXNK-HWKANZROSA-N
MW322.36 g/mol
LogP3.79
Rot. Bonds6

About 6-(methoxymethoxy)-2-[(E)-2-(2-methoxy-4-pyridinyl)ethenyl]quinoline

6-(methoxymethoxy)-2-[(E)-2-(2-methoxy-4-pyridinyl)ethenyl]quinoline (PubChem CID 130185200) has the molecular formula C19H18N2O3 and a molecular weight of 322.36 g/mol. Its IUPAC name is 6-(methoxymethoxy)-2-[(E)-2-(2-methoxy-4-pyridinyl)ethenyl]quinoline.

Molecular Properties

Compound Name6-(methoxymethoxy)-2-[(E)-2-(2-methoxy-4-pyridinyl)ethenyl]quinoline
PubChem CID130185200
Molecular FormulaC19H18N2O3
Molecular Weight322.36 g/mol
Exact Mass322.13
IUPAC Name6-(methoxymethoxy)-2-[(E)-2-(2-methoxy-4-pyridinyl)ethenyl]quinoline
SMILESCOCOc1ccc2nc(/C=C/c3ccnc(OC)c3)ccc2c1
InChIInChI=1S/C19H18N2O3/c1-22-13-24-17-7-8-18-15(12-17)4-6-16(21-18)5-3-14-9-10-20-19(11-14)23-2/h3-12H,13H2,1-2H3/b5-3+
InChIKeyGLPRKMPLQZOXNK-HWKANZROSA-N
XLogP3.79
TPSA53.47 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.36
LogP ≤ 53.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 6-(methoxymethoxy)-2-[(E)-2-(2-methoxy-4-pyridinyl)ethenyl]quinoline?
The IUPAC name of 6-(methoxymethoxy)-2-[(E)-2-(2-methoxy-4-pyridinyl)ethenyl]quinoline (CID 130185200) is 6-(methoxymethoxy)-2-[(E)-2-(2-methoxy-4-pyridinyl)ethenyl]quinoline.
What is the SMILES notation for 6-(methoxymethoxy)-2-[(E)-2-(2-methoxy-4-pyridinyl)ethenyl]quinoline?
The canonical SMILES for 6-(methoxymethoxy)-2-[(E)-2-(2-methoxy-4-pyridinyl)ethenyl]quinoline is COCOc1ccc2nc(/C=C/c3ccnc(OC)c3)ccc2c1.
What is the InChIKey of 6-(methoxymethoxy)-2-[(E)-2-(2-methoxy-4-pyridinyl)ethenyl]quinoline?
The InChIKey is GLPRKMPLQZOXNK-HWKANZROSA-N. The full InChI is InChI=1S/C19H18N2O3/c1-22-13-24-17-7-8-18-15(12-17)4-6-16(21-18)5-3-14-9-10-20-19(11-14)23-2/h3-12H,13H2,1-2H3/b5-3+.
What are the key properties of 6-(methoxymethoxy)-2-[(E)-2-(2-methoxy-4-pyridinyl)ethenyl]quinoline?
6-(methoxymethoxy)-2-[(E)-2-(2-methoxy-4-pyridinyl)ethenyl]quinoline has a molecular weight of 322.36 g/mol, XLogP of 3.79, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(methoxymethoxy)-2-[(E)-2-(2-methoxy-4-pyridinyl)ethenyl]quinoline is sourced from PubChem (CID 130185200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).