2-(2-chlorophenyl)-4-[6-(4-fluorophenyl)pyridazin-3-yl]morpholine

C20H17ClFN3O — CID 133289781

IUPAC2-(2-chlorophenyl)-4-[6-(4-fluorophenyl)pyridazin-3-yl]morpholine
SMILESFc1ccc(-c2ccc(N3CCOC(c4ccccc4Cl)C3)nn2)cc1
InChIInChI=1S/C20H17ClFN3O/c21-17-4-2-1-3-16(17)19-13-25(11-12-26-19)20-10-9-18(23-24-20)14-5-7-15(22)8-6-14/h1-10,19H,11-13H2
InChIKeyLBQODARUXFEUMO-UHFFFAOYSA-N
MW369.83 g/mol
LogP4.51
Rot. Bonds3

About 2-(2-chlorophenyl)-4-[6-(4-fluorophenyl)pyridazin-3-yl]morpholine

2-(2-chlorophenyl)-4-[6-(4-fluorophenyl)pyridazin-3-yl]morpholine (PubChem CID 133289781) has the molecular formula C20H17ClFN3O and a molecular weight of 369.83 g/mol. Its IUPAC name is 2-(2-chlorophenyl)-4-[6-(4-fluorophenyl)pyridazin-3-yl]morpholine.

Molecular Properties

Compound Name2-(2-chlorophenyl)-4-[6-(4-fluorophenyl)pyridazin-3-yl]morpholine
PubChem CID133289781
Molecular FormulaC20H17ClFN3O
Molecular Weight369.83 g/mol
Exact Mass369.10
IUPAC Name2-(2-chlorophenyl)-4-[6-(4-fluorophenyl)pyridazin-3-yl]morpholine
SMILESFc1ccc(-c2ccc(N3CCOC(c4ccccc4Cl)C3)nn2)cc1
InChIInChI=1S/C20H17ClFN3O/c21-17-4-2-1-3-16(17)19-13-25(11-12-26-19)20-10-9-18(23-24-20)14-5-7-15(22)8-6-14/h1-10,19H,11-13H2
InChIKeyLBQODARUXFEUMO-UHFFFAOYSA-N
XLogP4.51
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.83
LogP ≤ 54.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

(2S,3R,4R,5S,6R)-2-(4-chloro-3-((6-morpholinopyridazin-3-yl)methyl)phenyl)-6-(hydroxymethyl)tetrahydro-2H-pyran-3,4,5-triol
CID 46889775
4-[6-(2-Chlorophenyl)pyridazin-3-yl]morpholine
CID 46226067
[1-[6-(2-Chlorophenyl)pyridazin-3-yl]piperidin-4-yl] 4-chlorobenzoate
CID 13362214
4-[6-(2-Chloro-4-methoxyphenyl)pyridazin-3-yl]morpholine
CID 46226109
3-[4-[(2-Fluorophenyl)methyl]piperazin-1-yl]-6-(oxan-2-yl)pyridazine
CID 71083364
1-(4-(6-(2-Chlorophenyl)pyridazin-3-yl)piperazin-1-yl)-2-(2-fluorophenoxy)ethanone
CID 25842039
1-(4-(6-(2-Chlorophenyl)pyridazin-3-yl)piperazin-1-yl)-2-(4-fluorophenoxy)ethanone
CID 25842040
1-(4-(6-(2-Chlorophenyl)pyridazin-3-yl)piperazin-1-yl)-2-(3-fluorophenoxy)ethanone
CID 25842041
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
3-[2-(2-Chloro-4-fluorophenyl)morpholin-4-yl]-5,6-diethylpyridazine-4-carbonitrile
CID 132382013

Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenyl)-4-[6-(4-fluorophenyl)pyridazin-3-yl]morpholine?
The IUPAC name of 2-(2-chlorophenyl)-4-[6-(4-fluorophenyl)pyridazin-3-yl]morpholine (CID 133289781) is 2-(2-chlorophenyl)-4-[6-(4-fluorophenyl)pyridazin-3-yl]morpholine.
What is the SMILES notation for 2-(2-chlorophenyl)-4-[6-(4-fluorophenyl)pyridazin-3-yl]morpholine?
The canonical SMILES for 2-(2-chlorophenyl)-4-[6-(4-fluorophenyl)pyridazin-3-yl]morpholine is Fc1ccc(-c2ccc(N3CCOC(c4ccccc4Cl)C3)nn2)cc1.
What is the InChIKey of 2-(2-chlorophenyl)-4-[6-(4-fluorophenyl)pyridazin-3-yl]morpholine?
The InChIKey is LBQODARUXFEUMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17ClFN3O/c21-17-4-2-1-3-16(17)19-13-25(11-12-26-19)20-10-9-18(23-24-20)14-5-7-15(22)8-6-14/h1-10,19H,11-13H2.
What are the key properties of 2-(2-chlorophenyl)-4-[6-(4-fluorophenyl)pyridazin-3-yl]morpholine?
2-(2-chlorophenyl)-4-[6-(4-fluorophenyl)pyridazin-3-yl]morpholine has a molecular weight of 369.83 g/mol, XLogP of 4.51, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenyl)-4-[6-(4-fluorophenyl)pyridazin-3-yl]morpholine is sourced from PubChem (CID 133289781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).