(5Z)-5-[(2E)-2-(5-ethyl-1-methyl-2-pyridinylidene)ethylidene]quinolin-8-one

C19H18N2O — CID 6159879

IUPAC(5Z)-5-[(2E)-2-(5-ethyl-1-methyl-2-pyridinylidene)ethylidene]quinolin-8-one
SMILESCCC1=CN(C)/C(=C/C=C2/C=CC(=O)c3ncccc32)C=C1
InChIInChI=1S/C19H18N2O/c1-3-14-6-9-16(21(2)13-14)10-7-15-8-11-18(22)19-17(15)5-4-12-20-19/h4-13H,3H2,1-2H3/b15-7-,16-10+
InChIKeyQCCFGHDUTJUGMY-PCVUXADHSA-N
MW290.37 g/mol
LogP3.90
Rot. Bonds2

About (5Z)-5-[(2E)-2-(5-ethyl-1-methyl-2-pyridinylidene)ethylidene]quinolin-8-one

(5Z)-5-[(2E)-2-(5-ethyl-1-methyl-2-pyridinylidene)ethylidene]quinolin-8-one (PubChem CID 6159879) has the molecular formula C19H18N2O and a molecular weight of 290.37 g/mol. Its IUPAC name is (5Z)-5-[(2E)-2-(5-ethyl-1-methyl-2-pyridinylidene)ethylidene]quinolin-8-one.

Molecular Properties

Compound Name(5Z)-5-[(2E)-2-(5-ethyl-1-methyl-2-pyridinylidene)ethylidene]quinolin-8-one
PubChem CID6159879
Molecular FormulaC19H18N2O
Molecular Weight290.37 g/mol
Exact Mass290.14
IUPAC Name(5Z)-5-[(2E)-2-(5-ethyl-1-methyl-2-pyridinylidene)ethylidene]quinolin-8-one
SMILESCCC1=CN(C)/C(=C/C=C2/C=CC(=O)c3ncccc32)C=C1
InChIInChI=1S/C19H18N2O/c1-3-14-6-9-16(21(2)13-14)10-7-15-8-11-18(22)19-17(15)5-4-12-20-19/h4-13H,3H2,1-2H3/b15-7-,16-10+
InChIKeyQCCFGHDUTJUGMY-PCVUXADHSA-N
XLogP3.90
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 53.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

5-[2-(1-methyl-2-pyridinylidene)ethylidene]quinolin-8-one
CID 6822212
5-[2-(6-ethoxy-1-methylquinolin-2-ylidene)ethylidene]quinolin-8-one
CID 6786028
(5Z)-5-[(2Z)-2-(2-methylisoquinolin-1-ylidene)ethylidene]quinolin-8-one
CID 54612153
(5E)-5-[(2Z)-2-(1,6-dimethylquinolin-2-ylidene)ethylidene]quinolin-8-one
CID 5351203
5-methyl-7-[2-(1-methylquinolin-4-ylidene)ethylidene]quinolin-8-one
CID 6803592
5-methyl-7-[2-(1-methylquinolin-4-ylidene)ethylidene]quinolin-8-one;hydroiodide
CID 154734819
(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
4,7-phenanthroline-5,6-dione
CID 6764
1-methyl-2,3-dihydropyrido[2,3-e][1,4]oxazepin-5-one
CID 135067369
6-(hydroxymethyl)pyrrolo[3,4-b]pyridine-5,7-dione
CID 2133484
2-ethyl-5-methoxy-9-methyl-4,9,15-triazatricyclo[9.4.0.03,8]pentadeca-1(11),2,4,6,12,14-hexaen-10-one
CID 67579634

Frequently Asked Questions

What is the IUPAC name of (5Z)-5-[(2E)-2-(5-ethyl-1-methyl-2-pyridinylidene)ethylidene]quinolin-8-one?
The IUPAC name of (5Z)-5-[(2E)-2-(5-ethyl-1-methyl-2-pyridinylidene)ethylidene]quinolin-8-one (CID 6159879) is (5Z)-5-[(2E)-2-(5-ethyl-1-methyl-2-pyridinylidene)ethylidene]quinolin-8-one.
What is the SMILES notation for (5Z)-5-[(2E)-2-(5-ethyl-1-methyl-2-pyridinylidene)ethylidene]quinolin-8-one?
The canonical SMILES for (5Z)-5-[(2E)-2-(5-ethyl-1-methyl-2-pyridinylidene)ethylidene]quinolin-8-one is CCC1=CN(C)/C(=C/C=C2/C=CC(=O)c3ncccc32)C=C1.
What is the InChIKey of (5Z)-5-[(2E)-2-(5-ethyl-1-methyl-2-pyridinylidene)ethylidene]quinolin-8-one?
The InChIKey is QCCFGHDUTJUGMY-PCVUXADHSA-N. The full InChI is InChI=1S/C19H18N2O/c1-3-14-6-9-16(21(2)13-14)10-7-15-8-11-18(22)19-17(15)5-4-12-20-19/h4-13H,3H2,1-2H3/b15-7-,16-10+.
What are the key properties of (5Z)-5-[(2E)-2-(5-ethyl-1-methyl-2-pyridinylidene)ethylidene]quinolin-8-one?
(5Z)-5-[(2E)-2-(5-ethyl-1-methyl-2-pyridinylidene)ethylidene]quinolin-8-one has a molecular weight of 290.37 g/mol, XLogP of 3.90, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5Z)-5-[(2E)-2-(5-ethyl-1-methyl-2-pyridinylidene)ethylidene]quinolin-8-one is sourced from PubChem (CID 6159879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).