6-(2-ethyl-4-pyridinyl)-4-methoxyquinoline

C17H16N2O — CID 71064956

IUPAC6-(2-ethyl-4-pyridinyl)-4-methoxyquinoline
SMILESCCc1cc(-c2ccc3nccc(OC)c3c2)ccn1
InChIInChI=1S/C17H16N2O/c1-3-14-10-13(6-8-18-14)12-4-5-16-15(11-12)17(20-2)7-9-19-16/h4-11H,3H2,1-2H3
InChIKeyMSHMAAGAMAAFMD-UHFFFAOYSA-N
MW264.33 g/mol
LogP3.87
Rot. Bonds3

About 6-(2-ethyl-4-pyridinyl)-4-methoxyquinoline

6-(2-ethyl-4-pyridinyl)-4-methoxyquinoline (PubChem CID 71064956) has the molecular formula C17H16N2O and a molecular weight of 264.33 g/mol. Its IUPAC name is 6-(2-ethyl-4-pyridinyl)-4-methoxyquinoline.

Molecular Properties

Compound Name6-(2-ethyl-4-pyridinyl)-4-methoxyquinoline
PubChem CID71064956
Molecular FormulaC17H16N2O
Molecular Weight264.33 g/mol
Exact Mass264.13
IUPAC Name6-(2-ethyl-4-pyridinyl)-4-methoxyquinoline
SMILESCCc1cc(-c2ccc3nccc(OC)c3c2)ccn1
InChIInChI=1S/C17H16N2O/c1-3-14-10-13(6-8-18-14)12-4-5-16-15(11-12)17(20-2)7-9-19-16/h4-11H,3H2,1-2H3
InChIKeyMSHMAAGAMAAFMD-UHFFFAOYSA-N
XLogP3.87
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 53.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-(2-ethyl-4-pyridinyl)-4-methoxyquinoline?
The IUPAC name of 6-(2-ethyl-4-pyridinyl)-4-methoxyquinoline (CID 71064956) is 6-(2-ethyl-4-pyridinyl)-4-methoxyquinoline.
What is the SMILES notation for 6-(2-ethyl-4-pyridinyl)-4-methoxyquinoline?
The canonical SMILES for 6-(2-ethyl-4-pyridinyl)-4-methoxyquinoline is CCc1cc(-c2ccc3nccc(OC)c3c2)ccn1.
What is the InChIKey of 6-(2-ethyl-4-pyridinyl)-4-methoxyquinoline?
The InChIKey is MSHMAAGAMAAFMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O/c1-3-14-10-13(6-8-18-14)12-4-5-16-15(11-12)17(20-2)7-9-19-16/h4-11H,3H2,1-2H3.
What are the key properties of 6-(2-ethyl-4-pyridinyl)-4-methoxyquinoline?
6-(2-ethyl-4-pyridinyl)-4-methoxyquinoline has a molecular weight of 264.33 g/mol, XLogP of 3.87, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-ethyl-4-pyridinyl)-4-methoxyquinoline is sourced from PubChem (CID 71064956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).