N-[(4-fluorophenyl)methyl]-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide

C19H16FN3O2 — CID 3295263

IUPACN-[(4-fluorophenyl)methyl]-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide
SMILESO=C(Cn1nc(-c2ccccc2)ccc1=O)NCc1ccc(F)cc1
InChIInChI=1S/C19H16FN3O2/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/h1-11H,12-13H2,(H,21,24)
InChIKeyPZYJYEBPNDTYSV-UHFFFAOYSA-N
MW337.35 g/mol
LogP2.37
Rot. Bonds5

About N-[(4-fluorophenyl)methyl]-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide

N-[(4-fluorophenyl)methyl]-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide (PubChem CID 3295263) has the molecular formula C19H16FN3O2 and a molecular weight of 337.35 g/mol. Its IUPAC name is N-[(4-fluorophenyl)methyl]-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide.

Molecular Properties

Compound NameN-[(4-fluorophenyl)methyl]-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide
PubChem CID3295263
Molecular FormulaC19H16FN3O2
Molecular Weight337.35 g/mol
Exact Mass337.12
IUPAC NameN-[(4-fluorophenyl)methyl]-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide
SMILESO=C(Cn1nc(-c2ccccc2)ccc1=O)NCc1ccc(F)cc1
InChIInChI=1S/C19H16FN3O2/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/h1-11H,12-13H2,(H,21,24)
InChIKeyPZYJYEBPNDTYSV-UHFFFAOYSA-N
XLogP2.37
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.35
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(6-Oxo-3-phenylpyridazin-1(6H)-yl)-N-(1-phenylethyl)ethanimidic acid
CID 5053474
N-benzyl-3-[3-(4-fluorophenyl)-6-oxo-1(6H)-pyridazinyl]propanamide
CID 2810676
1-((R)-5-((S)-3-amino-2-fluoropropyl)-3-(2,5-difluorophenyl)-5-phenyl-4,5-dihydropyrazol-1-yl)ethanone
CID 11848366
(S)-1-(5-(3-aminopropyl)-3-(2,5-difluorophenyl)-5-phenyl-4,5-dihydropyrazol-1-yl)ethanone
CID 44435350
2-[(2E)-2-Benzylidenehydrazino]-2-oxo-N-(1-phenylethyl)acetamide
CID 5334512
2-[(2Z)-2-(1-methyl-3-phenylpropylidene)hydrazino]-2-oxo-N-(1-phenylethyl)acetamide
CID 6387008
2-(2-Oxo-2-piperidin-1-ylethyl)-6-phenylpyridazin-3-one
CID 5057198
1-benzyl-N-cycloheptyl-6-oxopyridazine-3-carboxamide
CID 2579680
N-(4-fluorobenzyl)-2-[3-(4-methylphenyl)-6-oxopyridazin-1(6H)-yl]acetamide
CID 4582595
N-butyl-2-[3-(4-methylphenyl)-6-oxopyridazin-1(6H)-yl]acetamide
CID 5099386
3-fluoro-N-(2-oxo-2-{(2E)-2-[(2E)-3-phenylprop-2-enylidene]hydrazino}ethyl)benzamide
CID 6870484
2-(4-fluorobenzyl)-6-phenylpyridazin-3(2H)-one
CID 7659607

Frequently Asked Questions

What is the IUPAC name of N-[(4-fluorophenyl)methyl]-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide?
The IUPAC name of N-[(4-fluorophenyl)methyl]-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide (CID 3295263) is N-[(4-fluorophenyl)methyl]-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide.
What is the SMILES notation for N-[(4-fluorophenyl)methyl]-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide?
The canonical SMILES for N-[(4-fluorophenyl)methyl]-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide is O=C(Cn1nc(-c2ccccc2)ccc1=O)NCc1ccc(F)cc1.
What is the InChIKey of N-[(4-fluorophenyl)methyl]-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide?
The InChIKey is PZYJYEBPNDTYSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16FN3O2/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/h1-11H,12-13H2,(H,21,24).
What are the key properties of N-[(4-fluorophenyl)methyl]-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide?
N-[(4-fluorophenyl)methyl]-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide has a molecular weight of 337.35 g/mol, XLogP of 2.37, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-fluorophenyl)methyl]-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide is sourced from PubChem (CID 3295263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).