2-[(E)-2-(6-methoxy-3-pyridinyl)ethenyl]-5,7-dimethylquinolin-8-ol

C19H18N2O2 — CID 118341280

IUPAC2-[(E)-2-(6-methoxy-3-pyridinyl)ethenyl]-5,7-dimethylquinolin-8-ol
SMILESCOc1ccc(/C=C/c2ccc3c(C)cc(C)c(O)c3n2)cn1
InChIInChI=1S/C19H18N2O2/c1-12-10-13(2)19(22)18-16(12)8-7-15(21-18)6-4-14-5-9-17(23-3)20-11-14/h4-11,22H,1-3H3/b6-4+
InChIKeyNYOIPKSDZCHGON-GQCTYLIASA-N
MW306.37 g/mol
LogP4.13
Rot. Bonds3

About 2-[(E)-2-(6-methoxy-3-pyridinyl)ethenyl]-5,7-dimethylquinolin-8-ol

2-[(E)-2-(6-methoxy-3-pyridinyl)ethenyl]-5,7-dimethylquinolin-8-ol (PubChem CID 118341280) has the molecular formula C19H18N2O2 and a molecular weight of 306.37 g/mol. Its IUPAC name is 2-[(E)-2-(6-methoxy-3-pyridinyl)ethenyl]-5,7-dimethylquinolin-8-ol.

Molecular Properties

Compound Name2-[(E)-2-(6-methoxy-3-pyridinyl)ethenyl]-5,7-dimethylquinolin-8-ol
PubChem CID118341280
Molecular FormulaC19H18N2O2
Molecular Weight306.37 g/mol
Exact Mass306.14
IUPAC Name2-[(E)-2-(6-methoxy-3-pyridinyl)ethenyl]-5,7-dimethylquinolin-8-ol
SMILESCOc1ccc(/C=C/c2ccc3c(C)cc(C)c(O)c3n2)cn1
InChIInChI=1S/C19H18N2O2/c1-12-10-13(2)19(22)18-16(12)8-7-15(21-18)6-4-14-5-9-17(23-3)20-11-14/h4-11,22H,1-3H3/b6-4+
InChIKeyNYOIPKSDZCHGON-GQCTYLIASA-N
XLogP4.13
TPSA55.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.37
LogP ≤ 54.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[(E)-2-(6-methoxy-3-pyridinyl)ethenyl]-5,7-dimethylquinolin-8-ol?
The IUPAC name of 2-[(E)-2-(6-methoxy-3-pyridinyl)ethenyl]-5,7-dimethylquinolin-8-ol (CID 118341280) is 2-[(E)-2-(6-methoxy-3-pyridinyl)ethenyl]-5,7-dimethylquinolin-8-ol.
What is the SMILES notation for 2-[(E)-2-(6-methoxy-3-pyridinyl)ethenyl]-5,7-dimethylquinolin-8-ol?
The canonical SMILES for 2-[(E)-2-(6-methoxy-3-pyridinyl)ethenyl]-5,7-dimethylquinolin-8-ol is COc1ccc(/C=C/c2ccc3c(C)cc(C)c(O)c3n2)cn1.
What is the InChIKey of 2-[(E)-2-(6-methoxy-3-pyridinyl)ethenyl]-5,7-dimethylquinolin-8-ol?
The InChIKey is NYOIPKSDZCHGON-GQCTYLIASA-N. The full InChI is InChI=1S/C19H18N2O2/c1-12-10-13(2)19(22)18-16(12)8-7-15(21-18)6-4-14-5-9-17(23-3)20-11-14/h4-11,22H,1-3H3/b6-4+.
What are the key properties of 2-[(E)-2-(6-methoxy-3-pyridinyl)ethenyl]-5,7-dimethylquinolin-8-ol?
2-[(E)-2-(6-methoxy-3-pyridinyl)ethenyl]-5,7-dimethylquinolin-8-ol has a molecular weight of 306.37 g/mol, XLogP of 4.13, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(E)-2-(6-methoxy-3-pyridinyl)ethenyl]-5,7-dimethylquinolin-8-ol is sourced from PubChem (CID 118341280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).