4'-[6-(4-fluorophenyl)pyridazin-3-yl]spiro[1,2-dihydroindene-3,2'-morpholine]

C22H20FN3O — CID 133413446

IUPAC4'-[6-(4-fluorophenyl)pyridazin-3-yl]spiro[1,2-dihydroindene-3,2'-morpholine]
SMILESFc1ccc(-c2ccc(N3CCOC4(CCc5ccccc54)C3)nn2)cc1
InChIInChI=1S/C22H20FN3O/c23-18-7-5-17(6-8-18)20-9-10-21(25-24-20)26-13-14-27-22(15-26)12-11-16-3-1-2-4-19(16)22/h1-10H,11-15H2
InChIKeyLSLLGNUPNXIFHY-UHFFFAOYSA-N
MW361.42 g/mol
LogP3.96
Rot. Bonds2

About 4'-[6-(4-fluorophenyl)pyridazin-3-yl]spiro[1,2-dihydroindene-3,2'-morpholine]

4'-[6-(4-fluorophenyl)pyridazin-3-yl]spiro[1,2-dihydroindene-3,2'-morpholine] (PubChem CID 133413446) has the molecular formula C22H20FN3O and a molecular weight of 361.42 g/mol. Its IUPAC name is 4'-[6-(4-fluorophenyl)pyridazin-3-yl]spiro[1,2-dihydroindene-3,2'-morpholine].

Molecular Properties

Compound Name4'-[6-(4-fluorophenyl)pyridazin-3-yl]spiro[1,2-dihydroindene-3,2'-morpholine]
PubChem CID133413446
Molecular FormulaC22H20FN3O
Molecular Weight361.42 g/mol
Exact Mass361.16
IUPAC Name4'-[6-(4-fluorophenyl)pyridazin-3-yl]spiro[1,2-dihydroindene-3,2'-morpholine]
SMILESFc1ccc(-c2ccc(N3CCOC4(CCc5ccccc54)C3)nn2)cc1
InChIInChI=1S/C22H20FN3O/c23-18-7-5-17(6-8-18)20-9-10-21(25-24-20)26-13-14-27-22(15-26)12-11-16-3-1-2-4-19(16)22/h1-10H,11-15H2
InChIKeyLSLLGNUPNXIFHY-UHFFFAOYSA-N
XLogP3.96
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.42
LogP ≤ 53.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 4'-[6-(4-fluorophenyl)pyridazin-3-yl]spiro[1,2-dihydroindene-3,2'-morpholine] with MolForge

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Related Compounds

3-[4-[(2-Fluorophenyl)methyl]piperazin-1-yl]-6-(oxan-2-yl)pyridazine
CID 71083364
3-[(2S)-2-(4-fluorophenyl)morpholin-4-yl]-5,6-dimethylpyridazine-4-carbonitrile
CID 36726887
3-[(2R)-2-(4-fluorophenyl)morpholin-4-yl]-5,6-dimethylpyridazine-4-carbonitrile
CID 36726888
3-[2-(4-Fluorophenyl)morpholin-4-yl]-5,6-dimethylpyridazine-4-carbonitrile
CID 45808705
2-(4-Bromophenyl)-4-[6-(4-fluorophenyl)pyridazin-3-yl]morpholine
CID 133274517
4-[6-(4-Fluorophenyl)pyridazin-3-yl]-2-methyl-6-phenylmorpholine
CID 133274561
2-(2-Chlorophenyl)-4-[6-(4-fluorophenyl)pyridazin-3-yl]morpholine
CID 133289781
2-(4-Fluorophenyl)-4-[6-(4-fluorophenyl)pyridazin-3-yl]-6-methylmorpholine
CID 133330370
3-[2-(4-Fluorophenyl)-6-methylmorpholin-4-yl]-5,6-dimethylpyridazine-4-carbonitrile
CID 133330515
4-[6-(4-Fluorophenyl)pyridazin-3-yl]-2-(2-methylphenyl)morpholine
CID 133354091
5,6-Diethyl-3-[2-(2-fluorophenyl)morpholin-4-yl]pyridazine-4-carbonitrile
CID 133361167
5,6-Diethyl-3-[2-(3-fluorophenyl)morpholin-4-yl]pyridazine-4-carbonitrile
CID 133361174

Frequently Asked Questions

What is the IUPAC name of 4'-[6-(4-fluorophenyl)pyridazin-3-yl]spiro[1,2-dihydroindene-3,2'-morpholine]?
The IUPAC name of 4'-[6-(4-fluorophenyl)pyridazin-3-yl]spiro[1,2-dihydroindene-3,2'-morpholine] (CID 133413446) is 4'-[6-(4-fluorophenyl)pyridazin-3-yl]spiro[1,2-dihydroindene-3,2'-morpholine].
What is the SMILES notation for 4'-[6-(4-fluorophenyl)pyridazin-3-yl]spiro[1,2-dihydroindene-3,2'-morpholine]?
The canonical SMILES for 4'-[6-(4-fluorophenyl)pyridazin-3-yl]spiro[1,2-dihydroindene-3,2'-morpholine] is Fc1ccc(-c2ccc(N3CCOC4(CCc5ccccc54)C3)nn2)cc1.
What is the InChIKey of 4'-[6-(4-fluorophenyl)pyridazin-3-yl]spiro[1,2-dihydroindene-3,2'-morpholine]?
The InChIKey is LSLLGNUPNXIFHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20FN3O/c23-18-7-5-17(6-8-18)20-9-10-21(25-24-20)26-13-14-27-22(15-26)12-11-16-3-1-2-4-19(16)22/h1-10H,11-15H2.
What are the key properties of 4'-[6-(4-fluorophenyl)pyridazin-3-yl]spiro[1,2-dihydroindene-3,2'-morpholine]?
4'-[6-(4-fluorophenyl)pyridazin-3-yl]spiro[1,2-dihydroindene-3,2'-morpholine] has a molecular weight of 361.42 g/mol, XLogP of 3.96, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4'-[6-(4-fluorophenyl)pyridazin-3-yl]spiro[1,2-dihydroindene-3,2'-morpholine] is sourced from PubChem (CID 133413446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).