N-[6-(4-fluoroanilino)-3-pyridinyl]-2-(2-fluorophenyl)acetamide

C19H15F2N3O — CID 113018345

IUPACN-[6-(4-fluoroanilino)-3-pyridinyl]-2-(2-fluorophenyl)acetamide
SMILESO=C(Cc1ccccc1F)Nc1ccc(Nc2ccc(F)cc2)nc1
InChIInChI=1S/C19H15F2N3O/c20-14-5-7-15(8-6-14)23-18-10-9-16(12-22-18)24-19(25)11-13-3-1-2-4-17(13)21/h1-10,12H,11H2,(H,22,23)(H,24,25)
InChIKeyFOMZJSOIQYTWGR-UHFFFAOYSA-N
MW339.35 g/mol
LogP4.28
Rot. Bonds5

About N-[6-(4-fluoroanilino)-3-pyridinyl]-2-(2-fluorophenyl)acetamide

N-[6-(4-fluoroanilino)-3-pyridinyl]-2-(2-fluorophenyl)acetamide (PubChem CID 113018345) has the molecular formula C19H15F2N3O and a molecular weight of 339.35 g/mol. Its IUPAC name is N-[6-(4-fluoroanilino)-3-pyridinyl]-2-(2-fluorophenyl)acetamide.

Molecular Properties

Compound NameN-[6-(4-fluoroanilino)-3-pyridinyl]-2-(2-fluorophenyl)acetamide
PubChem CID113018345
Molecular FormulaC19H15F2N3O
Molecular Weight339.35 g/mol
Exact Mass339.12
IUPAC NameN-[6-(4-fluoroanilino)-3-pyridinyl]-2-(2-fluorophenyl)acetamide
SMILESO=C(Cc1ccccc1F)Nc1ccc(Nc2ccc(F)cc2)nc1
InChIInChI=1S/C19H15F2N3O/c20-14-5-7-15(8-6-14)23-18-10-9-16(12-22-18)24-19(25)11-13-3-1-2-4-17(13)21/h1-10,12H,11H2,(H,22,23)(H,24,25)
InChIKeyFOMZJSOIQYTWGR-UHFFFAOYSA-N
XLogP4.28
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.35
LogP ≤ 54.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[6-(4-fluoroanilino)-3-pyridinyl]-2-(2-fluorophenyl)acetamide?
The IUPAC name of N-[6-(4-fluoroanilino)-3-pyridinyl]-2-(2-fluorophenyl)acetamide (CID 113018345) is N-[6-(4-fluoroanilino)-3-pyridinyl]-2-(2-fluorophenyl)acetamide.
What is the SMILES notation for N-[6-(4-fluoroanilino)-3-pyridinyl]-2-(2-fluorophenyl)acetamide?
The canonical SMILES for N-[6-(4-fluoroanilino)-3-pyridinyl]-2-(2-fluorophenyl)acetamide is O=C(Cc1ccccc1F)Nc1ccc(Nc2ccc(F)cc2)nc1.
What is the InChIKey of N-[6-(4-fluoroanilino)-3-pyridinyl]-2-(2-fluorophenyl)acetamide?
The InChIKey is FOMZJSOIQYTWGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15F2N3O/c20-14-5-7-15(8-6-14)23-18-10-9-16(12-22-18)24-19(25)11-13-3-1-2-4-17(13)21/h1-10,12H,11H2,(H,22,23)(H,24,25).
What are the key properties of N-[6-(4-fluoroanilino)-3-pyridinyl]-2-(2-fluorophenyl)acetamide?
N-[6-(4-fluoroanilino)-3-pyridinyl]-2-(2-fluorophenyl)acetamide has a molecular weight of 339.35 g/mol, XLogP of 4.28, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(4-fluoroanilino)-3-pyridinyl]-2-(2-fluorophenyl)acetamide is sourced from PubChem (CID 113018345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).