2-(2-morpholin-4-ylethyl)-6-(3-pyrazolo[1,5-a]pyridin-2-ylphenyl)pyridazin-3-one

C23H23N5O2 — CID 19767620

IUPAC2-(2-morpholin-4-ylethyl)-6-(3-pyrazolo[1,5-a]pyridin-2-ylphenyl)pyridazin-3-one
SMILESO=c1ccc(-c2cccc(-c3cc4ccccn4n3)c2)nn1CCN1CCOCC1
InChIInChI=1S/C23H23N5O2/c29-23-8-7-21(24-28(23)11-10-26-12-14-30-15-13-26)18-4-3-5-19(16-18)22-17-20-6-1-2-9-27(20)25-22/h1-9,16-17H,10-15H2
InChIKeyBHJHKINKHJWYKV-UHFFFAOYSA-N
MW401.47 g/mol
LogP2.56
Rot. Bonds5

About 2-(2-morpholin-4-ylethyl)-6-(3-pyrazolo[1,5-a]pyridin-2-ylphenyl)pyridazin-3-one

2-(2-morpholin-4-ylethyl)-6-(3-pyrazolo[1,5-a]pyridin-2-ylphenyl)pyridazin-3-one (PubChem CID 19767620) has the molecular formula C23H23N5O2 and a molecular weight of 401.47 g/mol. Its IUPAC name is 2-(2-morpholin-4-ylethyl)-6-(3-pyrazolo[1,5-a]pyridin-2-ylphenyl)pyridazin-3-one.

Molecular Properties

Compound Name2-(2-morpholin-4-ylethyl)-6-(3-pyrazolo[1,5-a]pyridin-2-ylphenyl)pyridazin-3-one
PubChem CID19767620
Molecular FormulaC23H23N5O2
Molecular Weight401.47 g/mol
Exact Mass401.19
IUPAC Name2-(2-morpholin-4-ylethyl)-6-(3-pyrazolo[1,5-a]pyridin-2-ylphenyl)pyridazin-3-one
SMILESO=c1ccc(-c2cccc(-c3cc4ccccn4n3)c2)nn1CCN1CCOCC1
InChIInChI=1S/C23H23N5O2/c29-23-8-7-21(24-28(23)11-10-26-12-14-30-15-13-26)18-4-3-5-19(16-18)22-17-20-6-1-2-9-27(20)25-22/h1-9,16-17H,10-15H2
InChIKeyBHJHKINKHJWYKV-UHFFFAOYSA-N
XLogP2.56
TPSA64.66 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500401.47
LogP ≤ 52.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Related Compounds

N-(2-morpholin-4-ylethyl)-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide
CID 5053341
2-[2-(azepan-1-yl)ethyl]-6-(2-phenylpyrazolo[1,5-a]pyridin-3-yl)pyridazin-3-one
CID 10982551
6-(2-ethylindolizin-3-yl)-2-(2-pyrrolidin-1-ylethyl)pyridazin-3-one
CID 118581176
6-(3-chlorophenyl)-2-(3-morpholin-4-ylpropyl)-4-phenylpyridazin-3-one
CID 3038268
2-[2-[4-(2-fluorophenyl)sulfonylpiperazin-1-yl]ethyl]-6-phenylpyridazin-3-one
CID 30864679
6-[2-[1-[4-amino-3-(3-fluoro-5-hydroxyphenyl)pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]indolizin-3-yl]-2-(2-morpholin-4-ylethyl)pyridazin-3-one
CID 118572891
[3-[[3-(3,5-difluorophenyl)-6-oxopyridazin-1-yl]methyl]phenyl]-(2-morpholin-4-ylethyl)carbamic acid
CID 67420778
[3-[[3-(3-cyanophenyl)-6-oxopyridazin-1-yl]methyl]phenyl]-(3-morpholin-4-ylpropyl)carbamic acid
CID 67420420
2-[2-[4-(3,4-dihydro-1H-isochromene-1-carbonyl)piperazin-1-yl]ethyl]-6-pyridin-3-ylpyridazin-3-one
CID 126915532
1-ethyl-3-[3-[[3-[3-(2-morpholin-4-ylethoxy)phenyl]-6-oxopyridazin-1-yl]methyl]phenyl]urea
CID 59849671
6-(3-bromophenyl)-2-[[4-[[3-(3-bromophenyl)-6-oxopyridazin-1-yl]methyl]piperazin-1-yl]methyl]pyridazin-3-one
CID 13235879
6-naphthalen-1-yl-2-(2-piperidin-1-ylethyl)pyridazin-3-one
CID 7664936

Frequently Asked Questions

What is the IUPAC name of 2-(2-morpholin-4-ylethyl)-6-(3-pyrazolo[1,5-a]pyridin-2-ylphenyl)pyridazin-3-one?
The IUPAC name of 2-(2-morpholin-4-ylethyl)-6-(3-pyrazolo[1,5-a]pyridin-2-ylphenyl)pyridazin-3-one (CID 19767620) is 2-(2-morpholin-4-ylethyl)-6-(3-pyrazolo[1,5-a]pyridin-2-ylphenyl)pyridazin-3-one.
What is the SMILES notation for 2-(2-morpholin-4-ylethyl)-6-(3-pyrazolo[1,5-a]pyridin-2-ylphenyl)pyridazin-3-one?
The canonical SMILES for 2-(2-morpholin-4-ylethyl)-6-(3-pyrazolo[1,5-a]pyridin-2-ylphenyl)pyridazin-3-one is O=c1ccc(-c2cccc(-c3cc4ccccn4n3)c2)nn1CCN1CCOCC1.
What is the InChIKey of 2-(2-morpholin-4-ylethyl)-6-(3-pyrazolo[1,5-a]pyridin-2-ylphenyl)pyridazin-3-one?
The InChIKey is BHJHKINKHJWYKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N5O2/c29-23-8-7-21(24-28(23)11-10-26-12-14-30-15-13-26)18-4-3-5-19(16-18)22-17-20-6-1-2-9-27(20)25-22/h1-9,16-17H,10-15H2.
What are the key properties of 2-(2-morpholin-4-ylethyl)-6-(3-pyrazolo[1,5-a]pyridin-2-ylphenyl)pyridazin-3-one?
2-(2-morpholin-4-ylethyl)-6-(3-pyrazolo[1,5-a]pyridin-2-ylphenyl)pyridazin-3-one has a molecular weight of 401.47 g/mol, XLogP of 2.56, 5 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-morpholin-4-ylethyl)-6-(3-pyrazolo[1,5-a]pyridin-2-ylphenyl)pyridazin-3-one is sourced from PubChem (CID 19767620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).