5-[2-(6-ethoxy-1-methylquinolin-2-ylidene)ethylidene]quinolin-8-one

C23H20N2O2 — CID 6786028

IUPAC5-[2-(6-ethoxy-1-methylquinolin-2-ylidene)ethylidene]quinolin-8-one
SMILESCCOc1ccc2c(c1)C=CC(=CC=C1C=CC(=O)c3ncccc31)N2C
InChIInChI=1S/C23H20N2O2/c1-3-27-19-11-12-21-17(15-19)7-10-18(25(21)2)9-6-16-8-13-22(26)23-20(16)5-4-14-24-23/h4-15H,3H2,1-2H3
InChIKeyFCFDWEARFQCYEH-UHFFFAOYSA-N
MW356.43 g/mol
LogP4.66
Rot. Bonds3

About 5-[2-(6-ethoxy-1-methylquinolin-2-ylidene)ethylidene]quinolin-8-one

5-[2-(6-ethoxy-1-methylquinolin-2-ylidene)ethylidene]quinolin-8-one (PubChem CID 6786028) has the molecular formula C23H20N2O2 and a molecular weight of 356.43 g/mol. Its IUPAC name is 5-[2-(6-ethoxy-1-methylquinolin-2-ylidene)ethylidene]quinolin-8-one.

Molecular Properties

Compound Name5-[2-(6-ethoxy-1-methylquinolin-2-ylidene)ethylidene]quinolin-8-one
PubChem CID6786028
Molecular FormulaC23H20N2O2
Molecular Weight356.43 g/mol
Exact Mass356.15
IUPAC Name5-[2-(6-ethoxy-1-methylquinolin-2-ylidene)ethylidene]quinolin-8-one
SMILESCCOc1ccc2c(c1)C=CC(=CC=C1C=CC(=O)c3ncccc31)N2C
InChIInChI=1S/C23H20N2O2/c1-3-27-19-11-12-21-17(15-19)7-10-18(25(21)2)9-6-16-8-13-22(26)23-20(16)5-4-14-24-23/h4-15H,3H2,1-2H3
InChIKeyFCFDWEARFQCYEH-UHFFFAOYSA-N
XLogP4.66
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.43
LogP ≤ 54.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

(5E)-5-[(2Z)-2-(1,6-dimethylquinolin-2-ylidene)ethylidene]quinolin-8-one
CID 5351203
4-[2-(6-ethoxy-1-methylquinolin-2-ylidene)ethylidene]quinolin-8-one
CID 6810352
(5Z)-5-[(2E)-2-(5-ethyl-1-methyl-2-pyridinylidene)ethylidene]quinolin-8-one
CID 6159879
5-[2-(1-methyl-2-pyridinylidene)ethylidene]quinolin-8-one
CID 6822212
(5Z)-5-[(2Z)-2-(2-methylisoquinolin-1-ylidene)ethylidene]quinolin-8-one
CID 54612153
(7E)-7-[(2Z)-2-(8-hydroxy-1-methylquinolin-2-ylidene)ethylidene]-5-methylquinolin-8-one
CID 54603064
(7E)-7-[(2Z)-2-(8-hydroxy-1-methylquinolin-2-ylidene)ethylidene]-5-methylquinolin-8-one;methyl hydrogen sulfate
CID 171376897
2-(2-amino-3-pyridinyl)-4-ethoxybenzaldehyde
CID 166594807
(3R)-5-ethoxy-1,3-dimethyl-3H-indol-2-one
CID 86313571
1-(4-ethoxyphenyl)-6-hydroxy-5-[(E)-pyrrolo[2,3-b]pyridin-3-ylidenemethyl]pyrimidine-2,4-dione
CID 135706692
2-(1-methylquinolin-2-ylidene)acetaldehyde
CID 4702150
6-ethoxy-1-methyl-2,3-dihydroquinolin-4-one
CID 82396270

Frequently Asked Questions

What is the IUPAC name of 5-[2-(6-ethoxy-1-methylquinolin-2-ylidene)ethylidene]quinolin-8-one?
The IUPAC name of 5-[2-(6-ethoxy-1-methylquinolin-2-ylidene)ethylidene]quinolin-8-one (CID 6786028) is 5-[2-(6-ethoxy-1-methylquinolin-2-ylidene)ethylidene]quinolin-8-one.
What is the SMILES notation for 5-[2-(6-ethoxy-1-methylquinolin-2-ylidene)ethylidene]quinolin-8-one?
The canonical SMILES for 5-[2-(6-ethoxy-1-methylquinolin-2-ylidene)ethylidene]quinolin-8-one is CCOc1ccc2c(c1)C=CC(=CC=C1C=CC(=O)c3ncccc31)N2C.
What is the InChIKey of 5-[2-(6-ethoxy-1-methylquinolin-2-ylidene)ethylidene]quinolin-8-one?
The InChIKey is FCFDWEARFQCYEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20N2O2/c1-3-27-19-11-12-21-17(15-19)7-10-18(25(21)2)9-6-16-8-13-22(26)23-20(16)5-4-14-24-23/h4-15H,3H2,1-2H3.
What are the key properties of 5-[2-(6-ethoxy-1-methylquinolin-2-ylidene)ethylidene]quinolin-8-one?
5-[2-(6-ethoxy-1-methylquinolin-2-ylidene)ethylidene]quinolin-8-one has a molecular weight of 356.43 g/mol, XLogP of 4.66, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-(6-ethoxy-1-methylquinolin-2-ylidene)ethylidene]quinolin-8-one is sourced from PubChem (CID 6786028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).