4-[2,5-dioxo-4-[(E)-2-phenylethenyl]-4,6,7,8-tetrahydro-3H-quinolin-1-yl]benzamide

C24H22N2O3 — CID 23802292

IUPAC4-[2,5-dioxo-4-[(E)-2-phenylethenyl]-4,6,7,8-tetrahydro-3H-quinolin-1-yl]benzamide
SMILESNC(=O)c1ccc(N2C(=O)CC(/C=C/c3ccccc3)C3=C2CCCC3=O)cc1
InChIInChI=1S/C24H22N2O3/c25-24(29)17-11-13-19(14-12-17)26-20-7-4-8-21(27)23(20)18(15-22(26)28)10-9-16-5-2-1-3-6-16/h1-3,5-6,9-14,18H,4,7-8,15H2,(H2,25,29)/b10-9+
InChIKeyUSRMXGGPAXUNOY-MDZDMXLPSA-N
MW386.45 g/mol
LogP3.86
Rot. Bonds4

About 4-[2,5-dioxo-4-[(E)-2-phenylethenyl]-4,6,7,8-tetrahydro-3H-quinolin-1-yl]benzamide

4-[2,5-dioxo-4-[(E)-2-phenylethenyl]-4,6,7,8-tetrahydro-3H-quinolin-1-yl]benzamide (PubChem CID 23802292) has the molecular formula C24H22N2O3 and a molecular weight of 386.45 g/mol. Its IUPAC name is 4-[2,5-dioxo-4-[(E)-2-phenylethenyl]-4,6,7,8-tetrahydro-3H-quinolin-1-yl]benzamide.

Molecular Properties

Compound Name4-[2,5-dioxo-4-[(E)-2-phenylethenyl]-4,6,7,8-tetrahydro-3H-quinolin-1-yl]benzamide
PubChem CID23802292
Molecular FormulaC24H22N2O3
Molecular Weight386.45 g/mol
Exact Mass386.16
IUPAC Name4-[2,5-dioxo-4-[(E)-2-phenylethenyl]-4,6,7,8-tetrahydro-3H-quinolin-1-yl]benzamide
SMILESNC(=O)c1ccc(N2C(=O)CC(/C=C/c3ccccc3)C3=C2CCCC3=O)cc1
InChIInChI=1S/C24H22N2O3/c25-24(29)17-11-13-19(14-12-17)26-20-7-4-8-21(27)23(20)18(15-22(26)28)10-9-16-5-2-1-3-6-16/h1-3,5-6,9-14,18H,4,7-8,15H2,(H2,25,29)/b10-9+
InChIKeyUSRMXGGPAXUNOY-MDZDMXLPSA-N
XLogP3.86
TPSA80.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.45
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-[2,5-dioxo-4-[(E)-2-phenylethenyl]-4,6,7,8-tetrahydro-3H-quinolin-1-yl]benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4,4'-Bis(dimethylamino)benzophenone
CID 7031
Ar-42
CID 6918848
4,4'-Bis(diethylamino)benzophenone
CID 66663
4'-Benzoylbenzanilide
CID 88168
4-Acetamidochalcone
CID 5896580
2-(4-Methylphenyl)isoquinoline-1,3(2H,4H)-dione
CID 3739108
N-Hydroxy-4-(4-phenyl-butyrylamino)-benzamide
CID 9994848
N-hydroxy-4-[[(2R)-2-phenylbutanoyl]amino]benzamide
CID 11231829
N-hydroxy-4-[[(2S)-2-phenylbutanoyl]amino]benzamide
CID 11312563
N-hydroxy-4-(2-phenylbutanoylamino)benzamide
CID 11347053
N-hydroxy-4-(5-phenylpentanoylamino)benzamide
CID 11472431
1,2-Bis(4-(dimethylamino)phenyl)ethane-1,2-dione
CID 222570

Frequently Asked Questions

What is the IUPAC name of 4-[2,5-dioxo-4-[(E)-2-phenylethenyl]-4,6,7,8-tetrahydro-3H-quinolin-1-yl]benzamide?
The IUPAC name of 4-[2,5-dioxo-4-[(E)-2-phenylethenyl]-4,6,7,8-tetrahydro-3H-quinolin-1-yl]benzamide (CID 23802292) is 4-[2,5-dioxo-4-[(E)-2-phenylethenyl]-4,6,7,8-tetrahydro-3H-quinolin-1-yl]benzamide.
What is the SMILES notation for 4-[2,5-dioxo-4-[(E)-2-phenylethenyl]-4,6,7,8-tetrahydro-3H-quinolin-1-yl]benzamide?
The canonical SMILES for 4-[2,5-dioxo-4-[(E)-2-phenylethenyl]-4,6,7,8-tetrahydro-3H-quinolin-1-yl]benzamide is NC(=O)c1ccc(N2C(=O)CC(/C=C/c3ccccc3)C3=C2CCCC3=O)cc1.
What is the InChIKey of 4-[2,5-dioxo-4-[(E)-2-phenylethenyl]-4,6,7,8-tetrahydro-3H-quinolin-1-yl]benzamide?
The InChIKey is USRMXGGPAXUNOY-MDZDMXLPSA-N. The full InChI is InChI=1S/C24H22N2O3/c25-24(29)17-11-13-19(14-12-17)26-20-7-4-8-21(27)23(20)18(15-22(26)28)10-9-16-5-2-1-3-6-16/h1-3,5-6,9-14,18H,4,7-8,15H2,(H2,25,29)/b10-9+.
What are the key properties of 4-[2,5-dioxo-4-[(E)-2-phenylethenyl]-4,6,7,8-tetrahydro-3H-quinolin-1-yl]benzamide?
4-[2,5-dioxo-4-[(E)-2-phenylethenyl]-4,6,7,8-tetrahydro-3H-quinolin-1-yl]benzamide has a molecular weight of 386.45 g/mol, XLogP of 3.86, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2,5-dioxo-4-[(E)-2-phenylethenyl]-4,6,7,8-tetrahydro-3H-quinolin-1-yl]benzamide is sourced from PubChem (CID 23802292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).