4-[2-(6-ethoxy-1-methylquinolin-2-ylidene)ethylidene]quinolin-8-one

C23H20N2O2 — CID 6810352

IUPAC4-[2-(6-ethoxy-1-methylquinolin-2-ylidene)ethylidene]quinolin-8-one
SMILESCCOc1ccc2c(c1)C=CC(=CC=c1ccnc3c1=CC=CC3=O)N2C
InChIInChI=1S/C23H20N2O2/c1-3-27-19-11-12-21-17(15-19)8-10-18(25(21)2)9-7-16-13-14-24-23-20(16)5-4-6-22(23)26/h4-15H,3H2,1-2H3
InChIKeyIYYKYRISNRPCIL-UHFFFAOYSA-N
MW356.43 g/mol
LogP2.84
Rot. Bonds3

About 4-[2-(6-ethoxy-1-methylquinolin-2-ylidene)ethylidene]quinolin-8-one

4-[2-(6-ethoxy-1-methylquinolin-2-ylidene)ethylidene]quinolin-8-one (PubChem CID 6810352) has the molecular formula C23H20N2O2 and a molecular weight of 356.43 g/mol. Its IUPAC name is 4-[2-(6-ethoxy-1-methylquinolin-2-ylidene)ethylidene]quinolin-8-one.

Molecular Properties

Compound Name4-[2-(6-ethoxy-1-methylquinolin-2-ylidene)ethylidene]quinolin-8-one
PubChem CID6810352
Molecular FormulaC23H20N2O2
Molecular Weight356.43 g/mol
Exact Mass356.15
IUPAC Name4-[2-(6-ethoxy-1-methylquinolin-2-ylidene)ethylidene]quinolin-8-one
SMILESCCOc1ccc2c(c1)C=CC(=CC=c1ccnc3c1=CC=CC3=O)N2C
InChIInChI=1S/C23H20N2O2/c1-3-27-19-11-12-21-17(15-19)8-10-18(25(21)2)9-7-16-13-14-24-23-20(16)5-4-6-22(23)26/h4-15H,3H2,1-2H3
InChIKeyIYYKYRISNRPCIL-UHFFFAOYSA-N
XLogP2.84
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 ≤ 52.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

5-[2-(6-ethoxy-1-methylquinolin-2-ylidene)ethylidene]quinolin-8-one
CID 6786028
(5E)-5-[(2Z)-2-(1,6-dimethylquinolin-2-ylidene)ethylidene]quinolin-8-one
CID 5351203
(3R)-5-ethoxy-1,3-dimethyl-3H-indol-2-one
CID 86313571
4-ethoxy-2-ethylpyridine
CID 59520086
1-(2,5-diethoxyphenyl)piperidin-4-one
CID 24711374
1-(2-chloro-4-ethoxyphenyl)pyrazole
CID 91589970
6-ethoxy-1-methyl-2,3-dihydroquinolin-4-one
CID 82396270
5-[(2,4-diethoxyphenyl)methylidene]-3-ethyl-1-methyl-2-sulfanylideneimidazolidin-4-one
CID 898699
7-ethoxy-2-methyl-1-oxo-[1,2,4]triazolo[4,3-a]quinoline-4-carbaldehyde
CID 43817922
6-ethoxy-1,2-benzothiazol-3-one
CID 54500484
8-ethoxy-5-oxidopyrazolo[5,1-c][1,2,4]benzotriazin-5-ium
CID 10398949
6-(4-ethoxyphenyl)-2-methyl-3-oxopyridazine-4-carbaldehyde
CID 82444330

Frequently Asked Questions

What is the IUPAC name of 4-[2-(6-ethoxy-1-methylquinolin-2-ylidene)ethylidene]quinolin-8-one?
The IUPAC name of 4-[2-(6-ethoxy-1-methylquinolin-2-ylidene)ethylidene]quinolin-8-one (CID 6810352) is 4-[2-(6-ethoxy-1-methylquinolin-2-ylidene)ethylidene]quinolin-8-one.
What is the SMILES notation for 4-[2-(6-ethoxy-1-methylquinolin-2-ylidene)ethylidene]quinolin-8-one?
The canonical SMILES for 4-[2-(6-ethoxy-1-methylquinolin-2-ylidene)ethylidene]quinolin-8-one is CCOc1ccc2c(c1)C=CC(=CC=c1ccnc3c1=CC=CC3=O)N2C.
What is the InChIKey of 4-[2-(6-ethoxy-1-methylquinolin-2-ylidene)ethylidene]quinolin-8-one?
The InChIKey is IYYKYRISNRPCIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20N2O2/c1-3-27-19-11-12-21-17(15-19)8-10-18(25(21)2)9-7-16-13-14-24-23-20(16)5-4-6-22(23)26/h4-15H,3H2,1-2H3.
What are the key properties of 4-[2-(6-ethoxy-1-methylquinolin-2-ylidene)ethylidene]quinolin-8-one?
4-[2-(6-ethoxy-1-methylquinolin-2-ylidene)ethylidene]quinolin-8-one has a molecular weight of 356.43 g/mol, XLogP of 2.84, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(6-ethoxy-1-methylquinolin-2-ylidene)ethylidene]quinolin-8-one is sourced from PubChem (CID 6810352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).