N-[(4-fluorophenyl)methyl]-2-(6-oxo-3-phenyl-4,5-dihydropyridazin-1-yl)acetamide

C19H18FN3O2 — CID 15995460

IUPACN-[(4-fluorophenyl)methyl]-2-(6-oxo-3-phenyl-4,5-dihydropyridazin-1-yl)acetamide
SMILESO=C(CN1N=C(c2ccccc2)CCC1=O)NCc1ccc(F)cc1
InChIInChI=1S/C19H18FN3O2/c20-16-8-6-14(7-9-16)12-21-18(24)13-23-19(25)11-10-17(22-23)15-4-2-1-3-5-15/h1-9H,10-13H2,(H,21,24)
InChIKeyDIZOVDATLATBNI-UHFFFAOYSA-N
MW339.37 g/mol
LogP2.47
Rot. Bonds5

About N-[(4-fluorophenyl)methyl]-2-(6-oxo-3-phenyl-4,5-dihydropyridazin-1-yl)acetamide

N-[(4-fluorophenyl)methyl]-2-(6-oxo-3-phenyl-4,5-dihydropyridazin-1-yl)acetamide (PubChem CID 15995460) has the molecular formula C19H18FN3O2 and a molecular weight of 339.37 g/mol. Its IUPAC name is N-[(4-fluorophenyl)methyl]-2-(6-oxo-3-phenyl-4,5-dihydropyridazin-1-yl)acetamide.

Molecular Properties

Compound NameN-[(4-fluorophenyl)methyl]-2-(6-oxo-3-phenyl-4,5-dihydropyridazin-1-yl)acetamide
PubChem CID15995460
Molecular FormulaC19H18FN3O2
Molecular Weight339.37 g/mol
Exact Mass339.14
IUPAC NameN-[(4-fluorophenyl)methyl]-2-(6-oxo-3-phenyl-4,5-dihydropyridazin-1-yl)acetamide
SMILESO=C(CN1N=C(c2ccccc2)CCC1=O)NCc1ccc(F)cc1
InChIInChI=1S/C19H18FN3O2/c20-16-8-6-14(7-9-16)12-21-18(24)13-23-19(25)11-10-17(22-23)15-4-2-1-3-5-15/h1-9H,10-13H2,(H,21,24)
InChIKeyDIZOVDATLATBNI-UHFFFAOYSA-N
XLogP2.47
TPSA61.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.37
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(4-fluorophenyl)methyl]-2-(6-oxo-3-phenyl-4,5-dihydropyridazin-1-yl)acetamide?
The IUPAC name of N-[(4-fluorophenyl)methyl]-2-(6-oxo-3-phenyl-4,5-dihydropyridazin-1-yl)acetamide (CID 15995460) is N-[(4-fluorophenyl)methyl]-2-(6-oxo-3-phenyl-4,5-dihydropyridazin-1-yl)acetamide.
What is the SMILES notation for N-[(4-fluorophenyl)methyl]-2-(6-oxo-3-phenyl-4,5-dihydropyridazin-1-yl)acetamide?
The canonical SMILES for N-[(4-fluorophenyl)methyl]-2-(6-oxo-3-phenyl-4,5-dihydropyridazin-1-yl)acetamide is O=C(CN1N=C(c2ccccc2)CCC1=O)NCc1ccc(F)cc1.
What is the InChIKey of N-[(4-fluorophenyl)methyl]-2-(6-oxo-3-phenyl-4,5-dihydropyridazin-1-yl)acetamide?
The InChIKey is DIZOVDATLATBNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18FN3O2/c20-16-8-6-14(7-9-16)12-21-18(24)13-23-19(25)11-10-17(22-23)15-4-2-1-3-5-15/h1-9H,10-13H2,(H,21,24).
What are the key properties of N-[(4-fluorophenyl)methyl]-2-(6-oxo-3-phenyl-4,5-dihydropyridazin-1-yl)acetamide?
N-[(4-fluorophenyl)methyl]-2-(6-oxo-3-phenyl-4,5-dihydropyridazin-1-yl)acetamide has a molecular weight of 339.37 g/mol, XLogP of 2.47, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-fluorophenyl)methyl]-2-(6-oxo-3-phenyl-4,5-dihydropyridazin-1-yl)acetamide is sourced from PubChem (CID 15995460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).