4-methoxy-N-[(E)-2-(4-methoxyphenyl)ethenyl]quinoline-2-carboxamide

C20H18N2O3 — CID 71567335

IUPAC4-methoxy-N-[(E)-2-(4-methoxyphenyl)ethenyl]quinoline-2-carboxamide
SMILESCOc1ccc(/C=C/NC(=O)c2cc(OC)c3ccccc3n2)cc1
InChIInChI=1S/C20H18N2O3/c1-24-15-9-7-14(8-10-15)11-12-21-20(23)18-13-19(25-2)16-5-3-4-6-17(16)22-18/h3-13H,1-2H3,(H,21,23)/b12-11+
InChIKeyIOIMYHGRFZTCMK-VAWYXSNFSA-N
MW334.38 g/mol
LogP3.65
Rot. Bonds5

About 4-methoxy-N-[(E)-2-(4-methoxyphenyl)ethenyl]quinoline-2-carboxamide

4-methoxy-N-[(E)-2-(4-methoxyphenyl)ethenyl]quinoline-2-carboxamide (PubChem CID 71567335) has the molecular formula C20H18N2O3 and a molecular weight of 334.38 g/mol. Its IUPAC name is 4-methoxy-N-[(E)-2-(4-methoxyphenyl)ethenyl]quinoline-2-carboxamide.

Molecular Properties

Compound Name4-methoxy-N-[(E)-2-(4-methoxyphenyl)ethenyl]quinoline-2-carboxamide
PubChem CID71567335
Molecular FormulaC20H18N2O3
Molecular Weight334.38 g/mol
Exact Mass334.13
IUPAC Name4-methoxy-N-[(E)-2-(4-methoxyphenyl)ethenyl]quinoline-2-carboxamide
SMILESCOc1ccc(/C=C/NC(=O)c2cc(OC)c3ccccc3n2)cc1
InChIInChI=1S/C20H18N2O3/c1-24-15-9-7-14(8-10-15)11-12-21-20(23)18-13-19(25-2)16-5-3-4-6-17(16)22-18/h3-13H,1-2H3,(H,21,23)/b12-11+
InChIKeyIOIMYHGRFZTCMK-VAWYXSNFSA-N
XLogP3.65
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.38
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-methoxy-N-[(E)-2-phenylethenyl]benzamide
CID 12560217
1-(4-methoxyquinolin-2-yl)ethanone
CID 22954601
N-[2-[4-(hydroxycarbamoyl)phenoxy]ethyl]-4-methoxyquinoline-2-carboxamide
CID 11417658
2-bromo-4,5-dimethoxy-N-[(Z)-2-(4-methoxyphenyl)ethenyl]benzamide
CID 14526427
2-bromo-4,5-dimethoxy-N-[(E)-2-(4-methoxyphenyl)ethenyl]benzamide
CID 14526426
4-methoxy-2-prop-1-en-2-ylquinoline
CID 119087132
2-[2-(4-methoxyphenyl)ethenyl]acridine-9-carboxylic acid
CID 152754992
4-methoxy-N-[2-oxo-2-[4-(2-phenoxyacetyl)piperazin-1-yl]ethyl]quinoline-2-carboxamide
CID 22184970
N-[1-(4-fluorophenyl)ethyl]-4-methoxyquinoline-2-carboxamide
CID 71824014
N-(furan-2-ylmethyl)-4-methoxyquinoline-2-carboxamide
CID 71824016
1-[(4-methoxyphenyl)methyl]-3-[(E)-2-phenylethenyl]urea
CID 108903141
4-methoxy-N-(2-pyridin-2-ylethyl)quinoline-2-carboxamide
CID 54723542

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-[(E)-2-(4-methoxyphenyl)ethenyl]quinoline-2-carboxamide?
The IUPAC name of 4-methoxy-N-[(E)-2-(4-methoxyphenyl)ethenyl]quinoline-2-carboxamide (CID 71567335) is 4-methoxy-N-[(E)-2-(4-methoxyphenyl)ethenyl]quinoline-2-carboxamide.
What is the SMILES notation for 4-methoxy-N-[(E)-2-(4-methoxyphenyl)ethenyl]quinoline-2-carboxamide?
The canonical SMILES for 4-methoxy-N-[(E)-2-(4-methoxyphenyl)ethenyl]quinoline-2-carboxamide is COc1ccc(/C=C/NC(=O)c2cc(OC)c3ccccc3n2)cc1.
What is the InChIKey of 4-methoxy-N-[(E)-2-(4-methoxyphenyl)ethenyl]quinoline-2-carboxamide?
The InChIKey is IOIMYHGRFZTCMK-VAWYXSNFSA-N. The full InChI is InChI=1S/C20H18N2O3/c1-24-15-9-7-14(8-10-15)11-12-21-20(23)18-13-19(25-2)16-5-3-4-6-17(16)22-18/h3-13H,1-2H3,(H,21,23)/b12-11+.
What are the key properties of 4-methoxy-N-[(E)-2-(4-methoxyphenyl)ethenyl]quinoline-2-carboxamide?
4-methoxy-N-[(E)-2-(4-methoxyphenyl)ethenyl]quinoline-2-carboxamide has a molecular weight of 334.38 g/mol, XLogP of 3.65, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-[(E)-2-(4-methoxyphenyl)ethenyl]quinoline-2-carboxamide is sourced from PubChem (CID 71567335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).