2-(3-chloro-9-oxoacridin-10-yl)-N-(3-chlorophenyl)acetamide

C21H14Cl2N2O2 — CID 22330394

IUPAC2-(3-chloro-9-oxoacridin-10-yl)-N-(3-chlorophenyl)acetamide
SMILESO=C(Cn1c2ccccc2c(=O)c2ccc(Cl)cc21)Nc1cccc(Cl)c1
InChIInChI=1S/C21H14Cl2N2O2/c22-13-4-3-5-15(10-13)24-20(26)12-25-18-7-2-1-6-16(18)21(27)17-9-8-14(23)11-19(17)25/h1-11H,12H2,(H,24,26)
InChIKeyYQZKNTMLHZWQLV-UHFFFAOYSA-N
MW397.26 g/mol
LogP5.10
Rot. Bonds3

About 2-(3-chloro-9-oxoacridin-10-yl)-N-(3-chlorophenyl)acetamide

2-(3-chloro-9-oxoacridin-10-yl)-N-(3-chlorophenyl)acetamide (PubChem CID 22330394) has the molecular formula C21H14Cl2N2O2 and a molecular weight of 397.26 g/mol. Its IUPAC name is 2-(3-chloro-9-oxoacridin-10-yl)-N-(3-chlorophenyl)acetamide.

Molecular Properties

Compound Name2-(3-chloro-9-oxoacridin-10-yl)-N-(3-chlorophenyl)acetamide
PubChem CID22330394
Molecular FormulaC21H14Cl2N2O2
Molecular Weight397.26 g/mol
Exact Mass396.04
IUPAC Name2-(3-chloro-9-oxoacridin-10-yl)-N-(3-chlorophenyl)acetamide
SMILESO=C(Cn1c2ccccc2c(=O)c2ccc(Cl)cc21)Nc1cccc(Cl)c1
InChIInChI=1S/C21H14Cl2N2O2/c22-13-4-3-5-15(10-13)24-20(26)12-25-18-7-2-1-6-16(18)21(27)17-9-8-14(23)11-19(17)25/h1-11H,12H2,(H,24,26)
InChIKeyYQZKNTMLHZWQLV-UHFFFAOYSA-N
XLogP5.10
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500397.26
LogP ≤ 55.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(3-chlorophenyl)-2-(9-oxoacridin-10-yl)acetamide
CID 15991917
1-(3-chlorophenyl)-3-[[2-(9-oxoacridin-10-yl)acetyl]amino]urea
CID 133064039
2-(3-chloro-9-oxoacridin-10-yl)-N-[4-(4-chlorophenoxy)phenyl]acetamide
CID 6615367
2-(3-chloro-9-oxoacridin-10-yl)-N-(5-fluoro-2-methylphenyl)acetamide
CID 22330410
N-(3-chlorophenyl)-2-(2-oxo-4-phenylquinazolin-1-yl)acetamide
CID 8721691
2-(azepan-1-yl)-N-[3-[[2-(9-oxoacridin-10-yl)acetyl]amino]phenyl]acetamide
CID 60622690
N,N-dimethyl-3-[[2-(9-oxoacridin-10-yl)acetyl]amino]benzamide
CID 51339146
N-(3-chlorophenyl)-2-[3-(3,5-dimethylphenyl)-2,4-dioxoquinazolin-1-yl]acetamide
CID 46857114
2-(2-methoxy-9-oxoacridin-10-yl)-N-(3-methoxyphenyl)acetamide
CID 15992736
2-(2-fluoro-9-oxoacridin-10-yl)-N-phenylacetamide
CID 166637503
N-(3-chlorophenyl)-2-(2,4-dioxo-1H-quinazolin-3-yl)acetamide
CID 4973865
N-(3-fluorophenyl)-2-(2-methyl-9-oxoacridin-10-yl)acetamide
CID 15993730

Frequently Asked Questions

What is the IUPAC name of 2-(3-chloro-9-oxoacridin-10-yl)-N-(3-chlorophenyl)acetamide?
The IUPAC name of 2-(3-chloro-9-oxoacridin-10-yl)-N-(3-chlorophenyl)acetamide (CID 22330394) is 2-(3-chloro-9-oxoacridin-10-yl)-N-(3-chlorophenyl)acetamide.
What is the SMILES notation for 2-(3-chloro-9-oxoacridin-10-yl)-N-(3-chlorophenyl)acetamide?
The canonical SMILES for 2-(3-chloro-9-oxoacridin-10-yl)-N-(3-chlorophenyl)acetamide is O=C(Cn1c2ccccc2c(=O)c2ccc(Cl)cc21)Nc1cccc(Cl)c1.
What is the InChIKey of 2-(3-chloro-9-oxoacridin-10-yl)-N-(3-chlorophenyl)acetamide?
The InChIKey is YQZKNTMLHZWQLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H14Cl2N2O2/c22-13-4-3-5-15(10-13)24-20(26)12-25-18-7-2-1-6-16(18)21(27)17-9-8-14(23)11-19(17)25/h1-11H,12H2,(H,24,26).
What are the key properties of 2-(3-chloro-9-oxoacridin-10-yl)-N-(3-chlorophenyl)acetamide?
2-(3-chloro-9-oxoacridin-10-yl)-N-(3-chlorophenyl)acetamide has a molecular weight of 397.26 g/mol, XLogP of 5.10, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chloro-9-oxoacridin-10-yl)-N-(3-chlorophenyl)acetamide is sourced from PubChem (CID 22330394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).