4-[2-fluoro-4-(4-methyl-6-methylidene-4,5-dihydro-1H-pyridazin-3-yl)phenyl]morpholine

C16H20FN3O — CID 118668772

IUPAC4-[2-fluoro-4-(4-methyl-6-methylidene-4,5-dihydro-1H-pyridazin-3-yl)phenyl]morpholine
SMILESC=C1CC(C)C(c2ccc(N3CCOCC3)c(F)c2)=NN1
InChIInChI=1S/C16H20FN3O/c1-11-9-12(2)18-19-16(11)13-3-4-15(14(17)10-13)20-5-7-21-8-6-20/h3-4,10-11,18H,2,5-9H2,1H3
InChIKeyCEZUHBOXWCDNHL-UHFFFAOYSA-N
MW289.35 g/mol
LogP2.51
Rot. Bonds2

About 4-[2-fluoro-4-(4-methyl-6-methylidene-4,5-dihydro-1H-pyridazin-3-yl)phenyl]morpholine

4-[2-fluoro-4-(4-methyl-6-methylidene-4,5-dihydro-1H-pyridazin-3-yl)phenyl]morpholine (PubChem CID 118668772) has the molecular formula C16H20FN3O and a molecular weight of 289.35 g/mol. Its IUPAC name is 4-[2-fluoro-4-(4-methyl-6-methylidene-4,5-dihydro-1H-pyridazin-3-yl)phenyl]morpholine.

Molecular Properties

Compound Name4-[2-fluoro-4-(4-methyl-6-methylidene-4,5-dihydro-1H-pyridazin-3-yl)phenyl]morpholine
PubChem CID118668772
Molecular FormulaC16H20FN3O
Molecular Weight289.35 g/mol
Exact Mass289.16
IUPAC Name4-[2-fluoro-4-(4-methyl-6-methylidene-4,5-dihydro-1H-pyridazin-3-yl)phenyl]morpholine
SMILESC=C1CC(C)C(c2ccc(N3CCOCC3)c(F)c2)=NN1
InChIInChI=1S/C16H20FN3O/c1-11-9-12(2)18-19-16(11)13-3-4-15(14(17)10-13)20-5-7-21-8-6-20/h3-4,10-11,18H,2,5-9H2,1H3
InChIKeyCEZUHBOXWCDNHL-UHFFFAOYSA-N
XLogP2.51
TPSA36.86 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.35
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-[2-fluoro-4-(4-methyl-6-methylidene-4,5-dihydro-1H-pyridazin-3-yl)phenyl]morpholine with MolForge

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Related Compounds

N-methyl-N-[(E)-(4-morpholin-4-ylphenyl)methylideneamino]methanamine
CID 6901444
4-(4-Morpholinyl)benzaldehyde (2-methylphenyl)hydrazone
CID 5336006
3-[4-morpholin-4-yl-3-(trifluoromethyl)phenyl]-1H-pyridazin-6-one
CID 44234821
Dnmdp-3
CID 71576758
4-(4-Morpholinyl)benzaldehyde phenylhydrazone
CID 5340585
N-benzyl-N-ethyl-4-[(E)-morpholin-4-yliminomethyl]aniline
CID 6902615
(4-Diethylamino-benzylidene)-morpholin-4-yl-amine
CID 9556656
(1E)-1-(3-fluoro-4-morpholin-4-ylphenyl)ethanone (4-fluorophenyl)hydrazone
CID 9600535
3-methyl-N'-{1-[4-(1-piperidinyl)phenyl]ethylidene}butanohydrazide
CID 9611814
2,4-difluoro-N-[(E)-(4-morpholin-4-ylphenyl)methylideneamino]aniline
CID 9625839
N-[(E)-1-(4-morpholin-4-ylphenyl)ethylideneamino]-4-nitroaniline
CID 9653225
N-[(E)-1-(4-morpholin-4-ylphenyl)ethylideneamino]cyclopropanecarboxamide
CID 9629992

Frequently Asked Questions

What is the IUPAC name of 4-[2-fluoro-4-(4-methyl-6-methylidene-4,5-dihydro-1H-pyridazin-3-yl)phenyl]morpholine?
The IUPAC name of 4-[2-fluoro-4-(4-methyl-6-methylidene-4,5-dihydro-1H-pyridazin-3-yl)phenyl]morpholine (CID 118668772) is 4-[2-fluoro-4-(4-methyl-6-methylidene-4,5-dihydro-1H-pyridazin-3-yl)phenyl]morpholine.
What is the SMILES notation for 4-[2-fluoro-4-(4-methyl-6-methylidene-4,5-dihydro-1H-pyridazin-3-yl)phenyl]morpholine?
The canonical SMILES for 4-[2-fluoro-4-(4-methyl-6-methylidene-4,5-dihydro-1H-pyridazin-3-yl)phenyl]morpholine is C=C1CC(C)C(c2ccc(N3CCOCC3)c(F)c2)=NN1.
What is the InChIKey of 4-[2-fluoro-4-(4-methyl-6-methylidene-4,5-dihydro-1H-pyridazin-3-yl)phenyl]morpholine?
The InChIKey is CEZUHBOXWCDNHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20FN3O/c1-11-9-12(2)18-19-16(11)13-3-4-15(14(17)10-13)20-5-7-21-8-6-20/h3-4,10-11,18H,2,5-9H2,1H3.
What are the key properties of 4-[2-fluoro-4-(4-methyl-6-methylidene-4,5-dihydro-1H-pyridazin-3-yl)phenyl]morpholine?
4-[2-fluoro-4-(4-methyl-6-methylidene-4,5-dihydro-1H-pyridazin-3-yl)phenyl]morpholine has a molecular weight of 289.35 g/mol, XLogP of 2.51, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-fluoro-4-(4-methyl-6-methylidene-4,5-dihydro-1H-pyridazin-3-yl)phenyl]morpholine is sourced from PubChem (CID 118668772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).