N-(3-fluorophenyl)-2-(2-methyl-9-oxoacridin-10-yl)acetamide

C22H17FN2O2 — CID 15993730

IUPACN-(3-fluorophenyl)-2-(2-methyl-9-oxoacridin-10-yl)acetamide
SMILESCc1ccc2c(c1)c(=O)c1ccccc1n2CC(=O)Nc1cccc(F)c1
InChIInChI=1S/C22H17FN2O2/c1-14-9-10-20-18(11-14)22(27)17-7-2-3-8-19(17)25(20)13-21(26)24-16-6-4-5-15(23)12-16/h2-12H,13H2,1H3,(H,24,26)
InChIKeyPIRJTUYWQRRZLW-UHFFFAOYSA-N
MW360.39 g/mol
LogP4.24
Rot. Bonds3

About N-(3-fluorophenyl)-2-(2-methyl-9-oxoacridin-10-yl)acetamide

N-(3-fluorophenyl)-2-(2-methyl-9-oxoacridin-10-yl)acetamide (PubChem CID 15993730) has the molecular formula C22H17FN2O2 and a molecular weight of 360.39 g/mol. Its IUPAC name is N-(3-fluorophenyl)-2-(2-methyl-9-oxoacridin-10-yl)acetamide.

Molecular Properties

Compound NameN-(3-fluorophenyl)-2-(2-methyl-9-oxoacridin-10-yl)acetamide
PubChem CID15993730
Molecular FormulaC22H17FN2O2
Molecular Weight360.39 g/mol
Exact Mass360.13
IUPAC NameN-(3-fluorophenyl)-2-(2-methyl-9-oxoacridin-10-yl)acetamide
SMILESCc1ccc2c(c1)c(=O)c1ccccc1n2CC(=O)Nc1cccc(F)c1
InChIInChI=1S/C22H17FN2O2/c1-14-9-10-20-18(11-14)22(27)17-7-2-3-8-19(17)25(20)13-21(26)24-16-6-4-5-15(23)12-16/h2-12H,13H2,1H3,(H,24,26)
InChIKeyPIRJTUYWQRRZLW-UHFFFAOYSA-N
XLogP4.24
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.39
LogP ≤ 54.24
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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Frequently Asked Questions

What is the IUPAC name of N-(3-fluorophenyl)-2-(2-methyl-9-oxoacridin-10-yl)acetamide?
The IUPAC name of N-(3-fluorophenyl)-2-(2-methyl-9-oxoacridin-10-yl)acetamide (CID 15993730) is N-(3-fluorophenyl)-2-(2-methyl-9-oxoacridin-10-yl)acetamide.
What is the SMILES notation for N-(3-fluorophenyl)-2-(2-methyl-9-oxoacridin-10-yl)acetamide?
The canonical SMILES for N-(3-fluorophenyl)-2-(2-methyl-9-oxoacridin-10-yl)acetamide is Cc1ccc2c(c1)c(=O)c1ccccc1n2CC(=O)Nc1cccc(F)c1.
What is the InChIKey of N-(3-fluorophenyl)-2-(2-methyl-9-oxoacridin-10-yl)acetamide?
The InChIKey is PIRJTUYWQRRZLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H17FN2O2/c1-14-9-10-20-18(11-14)22(27)17-7-2-3-8-19(17)25(20)13-21(26)24-16-6-4-5-15(23)12-16/h2-12H,13H2,1H3,(H,24,26).
What are the key properties of N-(3-fluorophenyl)-2-(2-methyl-9-oxoacridin-10-yl)acetamide?
N-(3-fluorophenyl)-2-(2-methyl-9-oxoacridin-10-yl)acetamide has a molecular weight of 360.39 g/mol, XLogP of 4.24, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluorophenyl)-2-(2-methyl-9-oxoacridin-10-yl)acetamide is sourced from PubChem (CID 15993730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).