1-(2,4-difluorophenyl)-2-pyridazin-3-ylethanone

C12H8F2N2O — CID 18956540

IUPAC1-(2,4-difluorophenyl)-2-pyridazin-3-ylethanone
SMILESO=C(Cc1cccnn1)c1ccc(F)cc1F
InChIInChI=1S/C12H8F2N2O/c13-8-3-4-10(11(14)6-8)12(17)7-9-2-1-5-15-16-9/h1-6H,7H2
InChIKeyLYHYUXYLUNLZMW-UHFFFAOYSA-N
MW234.21 g/mol
LogP2.18
Rot. Bonds3

About 1-(2,4-difluorophenyl)-2-pyridazin-3-ylethanone

1-(2,4-difluorophenyl)-2-pyridazin-3-ylethanone (PubChem CID 18956540) has the molecular formula C12H8F2N2O and a molecular weight of 234.21 g/mol. Its IUPAC name is 1-(2,4-difluorophenyl)-2-pyridazin-3-ylethanone.

Molecular Properties

Compound Name1-(2,4-difluorophenyl)-2-pyridazin-3-ylethanone
PubChem CID18956540
Molecular FormulaC12H8F2N2O
Molecular Weight234.21 g/mol
Exact Mass234.06
IUPAC Name1-(2,4-difluorophenyl)-2-pyridazin-3-ylethanone
SMILESO=C(Cc1cccnn1)c1ccc(F)cc1F
InChIInChI=1S/C12H8F2N2O/c13-8-3-4-10(11(14)6-8)12(17)7-9-2-1-5-15-16-9/h1-6H,7H2
InChIKeyLYHYUXYLUNLZMW-UHFFFAOYSA-N
XLogP2.18
TPSA42.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.21
LogP ≤ 52.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3-fluorophenyl)-2-pyridazin-3-ylethanone
CID 116832978
1-(3,4-difluorophenyl)-2-pyridazin-3-ylethanone
CID 116832929
1-(2,4-difluorophenyl)-2-(2-fluorophenyl)ethanone
CID 43337688
2-(2-chloro-3-fluorophenyl)-1-(2,4-difluorophenyl)ethanone
CID 112653310
2-bromo-1-(2,4-difluorophenyl)ethanone
CID 2774185
2-pyridazin-3-yl-1-thiophen-2-ylethanone
CID 116832889
1-(2,4-difluorophenyl)-2-(4-iodophenyl)ethanone
CID 65478906
1-(2,4-difluorophenyl)-2-(4-methylphenyl)ethanone
CID 43337683
1-(2,4-difluorophenyl)-2-pyrazol-1-ylethanone
CID 21253998
2-(2,5-dichlorophenyl)-1-(2,4-difluorophenyl)ethanone
CID 65317205
2,4-difluoro-N-(2-pyridin-2-ylethyl)benzamide
CID 51164132
1-(2,4-difluorophenyl)-4-methylpentane-1,3-dione
CID 63319815

Frequently Asked Questions

What is the IUPAC name of 1-(2,4-difluorophenyl)-2-pyridazin-3-ylethanone?
The IUPAC name of 1-(2,4-difluorophenyl)-2-pyridazin-3-ylethanone (CID 18956540) is 1-(2,4-difluorophenyl)-2-pyridazin-3-ylethanone.
What is the SMILES notation for 1-(2,4-difluorophenyl)-2-pyridazin-3-ylethanone?
The canonical SMILES for 1-(2,4-difluorophenyl)-2-pyridazin-3-ylethanone is O=C(Cc1cccnn1)c1ccc(F)cc1F.
What is the InChIKey of 1-(2,4-difluorophenyl)-2-pyridazin-3-ylethanone?
The InChIKey is LYHYUXYLUNLZMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8F2N2O/c13-8-3-4-10(11(14)6-8)12(17)7-9-2-1-5-15-16-9/h1-6H,7H2.
What are the key properties of 1-(2,4-difluorophenyl)-2-pyridazin-3-ylethanone?
1-(2,4-difluorophenyl)-2-pyridazin-3-ylethanone has a molecular weight of 234.21 g/mol, XLogP of 2.18, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4-difluorophenyl)-2-pyridazin-3-ylethanone is sourced from PubChem (CID 18956540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).