N-[6-(N-acetyl-4-fluoroanilino)pyridazin-4-yl]-2-(2,6-dichlorophenyl)acetamide

C20H15Cl2FN4O2 — CID 162428146

IUPACN-[6-(N-acetyl-4-fluoroanilino)pyridazin-4-yl]-2-(2,6-dichlorophenyl)acetamide
SMILESCC(=O)N(c1ccc(F)cc1)c1cc(NC(=O)Cc2c(Cl)cccc2Cl)cnn1
InChIInChI=1S/C20H15Cl2FN4O2/c1-12(28)27(15-7-5-13(23)6-8-15)19-9-14(11-24-26-19)25-20(29)10-16-17(21)3-2-4-18(16)22/h2-9,11H,10H2,1H3,(H,25,26,29)
InChIKeyNOBHMMIKDJMAIJ-UHFFFAOYSA-N
MW433.27 g/mol
LogP4.79
Rot. Bonds5

About N-[6-(N-acetyl-4-fluoroanilino)pyridazin-4-yl]-2-(2,6-dichlorophenyl)acetamide

N-[6-(N-acetyl-4-fluoroanilino)pyridazin-4-yl]-2-(2,6-dichlorophenyl)acetamide (PubChem CID 162428146) has the molecular formula C20H15Cl2FN4O2 and a molecular weight of 433.27 g/mol. Its IUPAC name is N-[6-(N-acetyl-4-fluoroanilino)pyridazin-4-yl]-2-(2,6-dichlorophenyl)acetamide.

Molecular Properties

Compound NameN-[6-(N-acetyl-4-fluoroanilino)pyridazin-4-yl]-2-(2,6-dichlorophenyl)acetamide
PubChem CID162428146
Molecular FormulaC20H15Cl2FN4O2
Molecular Weight433.27 g/mol
Exact Mass432.06
IUPAC NameN-[6-(N-acetyl-4-fluoroanilino)pyridazin-4-yl]-2-(2,6-dichlorophenyl)acetamide
SMILESCC(=O)N(c1ccc(F)cc1)c1cc(NC(=O)Cc2c(Cl)cccc2Cl)cnn1
InChIInChI=1S/C20H15Cl2FN4O2/c1-12(28)27(15-7-5-13(23)6-8-15)19-9-14(11-24-26-19)25-20(29)10-16-17(21)3-2-4-18(16)22/h2-9,11H,10H2,1H3,(H,25,26,29)
InChIKeyNOBHMMIKDJMAIJ-UHFFFAOYSA-N
XLogP4.79
TPSA75.19 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500433.27
LogP ≤ 54.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[6-(N-acetyl-4-fluoroanilino)pyridazin-4-yl]-2-(2,6-dichlorophenyl)acetamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[6-(N-acetyl-4-fluoroanilino)pyridazin-4-yl]-2-(2,6-dichlorophenyl)acetamide?
The IUPAC name of N-[6-(N-acetyl-4-fluoroanilino)pyridazin-4-yl]-2-(2,6-dichlorophenyl)acetamide (CID 162428146) is N-[6-(N-acetyl-4-fluoroanilino)pyridazin-4-yl]-2-(2,6-dichlorophenyl)acetamide.
What is the SMILES notation for N-[6-(N-acetyl-4-fluoroanilino)pyridazin-4-yl]-2-(2,6-dichlorophenyl)acetamide?
The canonical SMILES for N-[6-(N-acetyl-4-fluoroanilino)pyridazin-4-yl]-2-(2,6-dichlorophenyl)acetamide is CC(=O)N(c1ccc(F)cc1)c1cc(NC(=O)Cc2c(Cl)cccc2Cl)cnn1.
What is the InChIKey of N-[6-(N-acetyl-4-fluoroanilino)pyridazin-4-yl]-2-(2,6-dichlorophenyl)acetamide?
The InChIKey is NOBHMMIKDJMAIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15Cl2FN4O2/c1-12(28)27(15-7-5-13(23)6-8-15)19-9-14(11-24-26-19)25-20(29)10-16-17(21)3-2-4-18(16)22/h2-9,11H,10H2,1H3,(H,25,26,29).
What are the key properties of N-[6-(N-acetyl-4-fluoroanilino)pyridazin-4-yl]-2-(2,6-dichlorophenyl)acetamide?
N-[6-(N-acetyl-4-fluoroanilino)pyridazin-4-yl]-2-(2,6-dichlorophenyl)acetamide has a molecular weight of 433.27 g/mol, XLogP of 4.79, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(N-acetyl-4-fluoroanilino)pyridazin-4-yl]-2-(2,6-dichlorophenyl)acetamide is sourced from PubChem (CID 162428146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).