(E)-N-(8-methoxy-4-methyl-2-oxo-1H-quinolin-6-yl)-2-methyl-4-methylidenehex-2-enamide

C19H22N2O3 — CID 169247733

IUPAC(E)-N-(8-methoxy-4-methyl-2-oxo-1H-quinolin-6-yl)-2-methyl-4-methylidenehex-2-enamide
SMILESC=C(/C=C(\C)C(=O)Nc1cc(OC)c2[nH]c(=O)cc(C)c2c1)CC
InChIInChI=1S/C19H22N2O3/c1-6-11(2)7-13(4)19(23)20-14-9-15-12(3)8-17(22)21-18(15)16(10-14)24-5/h7-10H,2,6H2,1,3-5H3,(H,20,23)(H,21,22)/b13-7+
InChIKeyMOLDVCFETDRRRD-NTUHNPAUSA-N
MW326.40 g/mol
LogP3.70
Rot. Bonds5

About (E)-N-(8-methoxy-4-methyl-2-oxo-1H-quinolin-6-yl)-2-methyl-4-methylidenehex-2-enamide

(E)-N-(8-methoxy-4-methyl-2-oxo-1H-quinolin-6-yl)-2-methyl-4-methylidenehex-2-enamide (PubChem CID 169247733) has the molecular formula C19H22N2O3 and a molecular weight of 326.40 g/mol. Its IUPAC name is (E)-N-(8-methoxy-4-methyl-2-oxo-1H-quinolin-6-yl)-2-methyl-4-methylidenehex-2-enamide.

Molecular Properties

Compound Name(E)-N-(8-methoxy-4-methyl-2-oxo-1H-quinolin-6-yl)-2-methyl-4-methylidenehex-2-enamide
PubChem CID169247733
Molecular FormulaC19H22N2O3
Molecular Weight326.40 g/mol
Exact Mass326.16
IUPAC Name(E)-N-(8-methoxy-4-methyl-2-oxo-1H-quinolin-6-yl)-2-methyl-4-methylidenehex-2-enamide
SMILESC=C(/C=C(\C)C(=O)Nc1cc(OC)c2[nH]c(=O)cc(C)c2c1)CC
InChIInChI=1S/C19H22N2O3/c1-6-11(2)7-13(4)19(23)20-14-9-15-12(3)8-17(22)21-18(15)16(10-14)24-5/h7-10H,2,6H2,1,3-5H3,(H,20,23)(H,21,22)/b13-7+
InChIKeyMOLDVCFETDRRRD-NTUHNPAUSA-N
XLogP3.70
TPSA71.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 53.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

Analyze (E)-N-(8-methoxy-4-methyl-2-oxo-1H-quinolin-6-yl)-2-methyl-4-methylidenehex-2-enamide with MolForge

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Launch Full Analysis

Related Compounds

6-amino-8-methoxy-4-methyl-1H-quinolin-2-one;ethane
CID 169247715
N-(5,8-dimethoxy-4-methyl-2-oxo-1H-quinolin-6-yl)-3-oxobutanamide
CID 15757685
N-(3-methoxy-4-methylphenyl)-2-methylprop-2-enamide
CID 134123045
N-(5,8-dimethoxy-4-methyl-2-oxo-1H-quinolin-6-yl)-2-methylpropanamide
CID 144879713
N-(8-methoxy-4-methyl-2-oxo-1H-quinolin-6-yl)-2-[(2S)-2-methylpyrrolidin-1-yl]-5,7-dihydrofuro[3,4-b]pyridine-3-carboxamide
CID 170309307
N-(8-methoxy-4-methyl-2-oxo-1H-quinolin-6-yl)-2-(1-methyl-2-azabicyclo[2.1.1]hexan-2-yl)-5,7-dihydrofuro[3,4-b]pyridine-3-carboxamide
CID 170309320
2-(3,3-difluoropyrrolidin-1-yl)-N-(8-methoxy-4-methyl-2-oxo-1H-quinolin-6-yl)-5,7-dihydrofuro[3,4-b]pyridine-3-carboxamide
CID 169247762
dimethyl (E)-2-[(4-methyl-2-oxo-1H-quinolin-6-yl)amino]but-2-enedioate
CID 168568951
diethyl 2-[3-(8-methoxy-6-methyl-2-oxo-1H-quinolin-5-yl)propyl]propanedioate
CID 69370991
2-(prop-2-enylamino)-N-(3,4,5-trimethoxyphenyl)acetamide
CID 78908488
5-[1-(3,4-dimethoxy-5-methylanilino)ethenylamino]-1,3-dihydrobenzimidazol-2-one
CID 155114034
ethyl 4-[(4,8-dimethyl-2-oxo-1H-quinolin-6-yl)sulfonylamino]benzoate
CID 18592806

Frequently Asked Questions

What is the IUPAC name of (E)-N-(8-methoxy-4-methyl-2-oxo-1H-quinolin-6-yl)-2-methyl-4-methylidenehex-2-enamide?
The IUPAC name of (E)-N-(8-methoxy-4-methyl-2-oxo-1H-quinolin-6-yl)-2-methyl-4-methylidenehex-2-enamide (CID 169247733) is (E)-N-(8-methoxy-4-methyl-2-oxo-1H-quinolin-6-yl)-2-methyl-4-methylidenehex-2-enamide.
What is the SMILES notation for (E)-N-(8-methoxy-4-methyl-2-oxo-1H-quinolin-6-yl)-2-methyl-4-methylidenehex-2-enamide?
The canonical SMILES for (E)-N-(8-methoxy-4-methyl-2-oxo-1H-quinolin-6-yl)-2-methyl-4-methylidenehex-2-enamide is C=C(/C=C(\C)C(=O)Nc1cc(OC)c2[nH]c(=O)cc(C)c2c1)CC.
What is the InChIKey of (E)-N-(8-methoxy-4-methyl-2-oxo-1H-quinolin-6-yl)-2-methyl-4-methylidenehex-2-enamide?
The InChIKey is MOLDVCFETDRRRD-NTUHNPAUSA-N. The full InChI is InChI=1S/C19H22N2O3/c1-6-11(2)7-13(4)19(23)20-14-9-15-12(3)8-17(22)21-18(15)16(10-14)24-5/h7-10H,2,6H2,1,3-5H3,(H,20,23)(H,21,22)/b13-7+.
What are the key properties of (E)-N-(8-methoxy-4-methyl-2-oxo-1H-quinolin-6-yl)-2-methyl-4-methylidenehex-2-enamide?
(E)-N-(8-methoxy-4-methyl-2-oxo-1H-quinolin-6-yl)-2-methyl-4-methylidenehex-2-enamide has a molecular weight of 326.40 g/mol, XLogP of 3.70, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N-(8-methoxy-4-methyl-2-oxo-1H-quinolin-6-yl)-2-methyl-4-methylidenehex-2-enamide is sourced from PubChem (CID 169247733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).