2-(9-oxoacridin-10-yl)-N-(3,4,5-trimethoxyphenyl)acetamide

C24H22N2O5 — CID 6738020

IUPAC2-(9-oxoacridin-10-yl)-N-(3,4,5-trimethoxyphenyl)acetamide
SMILESCOc1cc(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)cc(OC)c1OC
InChIInChI=1S/C24H22N2O5/c1-29-20-12-15(13-21(30-2)24(20)31-3)25-22(27)14-26-18-10-6-4-8-16(18)23(28)17-9-5-7-11-19(17)26/h4-13H,14H2,1-3H3,(H,25,27)
InChIKeySLCKRVHLPLZFOU-UHFFFAOYSA-N
MW418.45 g/mol
LogP3.82
Rot. Bonds6

About 2-(9-oxoacridin-10-yl)-N-(3,4,5-trimethoxyphenyl)acetamide

2-(9-oxoacridin-10-yl)-N-(3,4,5-trimethoxyphenyl)acetamide (PubChem CID 6738020) has the molecular formula C24H22N2O5 and a molecular weight of 418.45 g/mol. Its IUPAC name is 2-(9-oxoacridin-10-yl)-N-(3,4,5-trimethoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(9-oxoacridin-10-yl)-N-(3,4,5-trimethoxyphenyl)acetamide
PubChem CID6738020
Molecular FormulaC24H22N2O5
Molecular Weight418.45 g/mol
Exact Mass418.15
IUPAC Name2-(9-oxoacridin-10-yl)-N-(3,4,5-trimethoxyphenyl)acetamide
SMILESCOc1cc(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)cc(OC)c1OC
InChIInChI=1S/C24H22N2O5/c1-29-20-12-15(13-21(30-2)24(20)31-3)25-22(27)14-26-18-10-6-4-8-16(18)23(28)17-9-5-7-11-19(17)26/h4-13H,14H2,1-3H3,(H,25,27)
InChIKeySLCKRVHLPLZFOU-UHFFFAOYSA-N
XLogP3.82
TPSA78.79 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500418.45
LogP ≤ 53.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Related Compounds

1-{[(3,4,5-trimethoxyphenyl)amino]methyl}-2,3-dihydro-1H-indole-2,3-dione
CID 2731732
2-(2,4-dioxo-3-(3,4,5-trimethoxyphenyl)-3,4-dihydroquinazolin-1(2H)-yl)-N-ethyl-N-(m-tolyl)acetamide
CID 16193658
(3Z)-3-benzylidene-N-tert-butyl-4-oxo-2-phenyl-1-(3,4,5-trimethoxyphenyl)azetidine-2-carboxamide
CID 145956362
(3Z)-3-benzylidene-N-tert-butyl-2-(3,5-difluorophenyl)-4-oxo-1-(3,4,5-trimethoxyphenyl)azetidine-2-carboxamide
CID 145971293
3-(2-Diethylaminoethyl)-2-(3,4,5-trimethoxyphenyl)-1,2-dihydroquinazolin-4-one
CID 659135
2-[6,7-Dimethoxy-2,4-dioxo-3-(2-phenylethyl)-1,2,3,4-tetrahydroquinazolin-1-YL]-N-phenylacetamide
CID 15989492
2-{3-[(2-Chlorophenyl)methyl]-6,7-dimethoxy-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-1-YL}-N-(3,5-dimethoxyphenyl)acetamide
CID 15989677
N-(2-aminophenyl)-4-[(E)-3-(3,4,5-trimethoxyanilino)prop-1-enyl]benzamide
CID 44457010
N-(2,3-Dihydro-benzo[1,4]dioxin-6-yl)-2-[4-(4-methyl-benzoyl)-piperidin-1-yl]-acetamide
CID 644916
2-{[N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(methylsulfonyl)glycyl]amino}-N-(2-phenylethyl)benzamide
CID 1313390
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(3,5-dimethoxybenzoyl)-4-piperidinecarboxamide
CID 1327634
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[6-methoxy-3-(4-methoxybenzoyl)-4-oxoquinolin-1-yl]acetamide
CID 2135368

Frequently Asked Questions

What is the IUPAC name of 2-(9-oxoacridin-10-yl)-N-(3,4,5-trimethoxyphenyl)acetamide?
The IUPAC name of 2-(9-oxoacridin-10-yl)-N-(3,4,5-trimethoxyphenyl)acetamide (CID 6738020) is 2-(9-oxoacridin-10-yl)-N-(3,4,5-trimethoxyphenyl)acetamide.
What is the SMILES notation for 2-(9-oxoacridin-10-yl)-N-(3,4,5-trimethoxyphenyl)acetamide?
The canonical SMILES for 2-(9-oxoacridin-10-yl)-N-(3,4,5-trimethoxyphenyl)acetamide is COc1cc(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)cc(OC)c1OC.
What is the InChIKey of 2-(9-oxoacridin-10-yl)-N-(3,4,5-trimethoxyphenyl)acetamide?
The InChIKey is SLCKRVHLPLZFOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22N2O5/c1-29-20-12-15(13-21(30-2)24(20)31-3)25-22(27)14-26-18-10-6-4-8-16(18)23(28)17-9-5-7-11-19(17)26/h4-13H,14H2,1-3H3,(H,25,27).
What are the key properties of 2-(9-oxoacridin-10-yl)-N-(3,4,5-trimethoxyphenyl)acetamide?
2-(9-oxoacridin-10-yl)-N-(3,4,5-trimethoxyphenyl)acetamide has a molecular weight of 418.45 g/mol, XLogP of 3.82, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(9-oxoacridin-10-yl)-N-(3,4,5-trimethoxyphenyl)acetamide is sourced from PubChem (CID 6738020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).