2-[2-(7-methoxyquinolin-4-yl)oxyethyl]-6-phenylpyridazin-3-one

C22H19N3O3 — CID 25016340

IUPAC2-[2-(7-methoxyquinolin-4-yl)oxyethyl]-6-phenylpyridazin-3-one
SMILESCOc1ccc2c(OCCn3nc(-c4ccccc4)ccc3=O)ccnc2c1
InChIInChI=1S/C22H19N3O3/c1-27-17-7-8-18-20(15-17)23-12-11-21(18)28-14-13-25-22(26)10-9-19(24-25)16-5-3-2-4-6-16/h2-12,15H,13-14H2,1H3
InChIKeyREBSFDUDIWPZBC-UHFFFAOYSA-N
MW373.41 g/mol
LogP3.55
Rot. Bonds6

About 2-[2-(7-methoxyquinolin-4-yl)oxyethyl]-6-phenylpyridazin-3-one

2-[2-(7-methoxyquinolin-4-yl)oxyethyl]-6-phenylpyridazin-3-one (PubChem CID 25016340) has the molecular formula C22H19N3O3 and a molecular weight of 373.41 g/mol. Its IUPAC name is 2-[2-(7-methoxyquinolin-4-yl)oxyethyl]-6-phenylpyridazin-3-one.

Molecular Properties

Compound Name2-[2-(7-methoxyquinolin-4-yl)oxyethyl]-6-phenylpyridazin-3-one
PubChem CID25016340
Molecular FormulaC22H19N3O3
Molecular Weight373.41 g/mol
Exact Mass373.14
IUPAC Name2-[2-(7-methoxyquinolin-4-yl)oxyethyl]-6-phenylpyridazin-3-one
SMILESCOc1ccc2c(OCCn3nc(-c4ccccc4)ccc3=O)ccnc2c1
InChIInChI=1S/C22H19N3O3/c1-27-17-7-8-18-20(15-17)23-12-11-21(18)28-14-13-25-22(26)10-9-19(24-25)16-5-3-2-4-6-16/h2-12,15H,13-14H2,1H3
InChIKeyREBSFDUDIWPZBC-UHFFFAOYSA-N
XLogP3.55
TPSA66.24 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.41
LogP ≤ 53.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 2-[2-(7-methoxyquinolin-4-yl)oxyethyl]-6-phenylpyridazin-3-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-(4-fluorophenyl)-2-[2-(7-methoxyquinolin-4-yl)oxyethyl]pyridazin-3-one
CID 25019685
2-[2-(7-methoxyquinolin-4-yl)oxyethyl]-6-(5-methyl-2-pyridinyl)pyridazin-3-one
CID 25016081
6-[4-[(1S)-1-aminoethyl]-3-chlorophenyl]-2-[2-(7-methoxyquinolin-4-yl)oxyethyl]pyridazin-3-one
CID 59843083
2-[2-[(7-methoxyquinolin-4-yl)amino]ethyl]-6-phenylpyridazin-3-one
CID 59843110
(R)-N-[(1R)-1-[2-chloro-4-[1-[2-(7-methoxyquinolin-4-yl)oxyethyl]-6-oxopyridazin-3-yl]phenyl]-2,2,2-trifluoroethyl]-2-methylpropane-2-sulfinamide
CID 59843093
7-methoxy-4-[(6-phenyl-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)methoxy]quinoline
CID 24864821
1-[2-(7-methoxyquinolin-4-yl)oxyethyl]-5-naphthalen-2-ylpyridin-2-one
CID 59843103
6-(6-fluoro-3-methoxyindol-1-yl)-2-[2-(7-methoxyquinolin-4-yl)oxyethyl]pyridazin-3-one
CID 73387530
[3-[1-[2-[6-(1,2-dihydroxyethyl)-7-methoxyquinolin-4-yl]oxyethyl]-6-oxopyridazin-3-yl]phenyl]-methylcarbamic acid
CID 68818487
[3-[1-[2-[6-(1,2-dihydroxyethyl)-7-methoxyquinolin-4-yl]oxyethyl]-6-oxopyridazin-3-yl]phenyl]methylcarbamic acid
CID 68818486
2-[3-(7-methoxyquinolin-4-yl)oxyprop-1-en-2-yl]-N-methyl-6-phenylpyridazin-3-imine
CID 143611176
5-(4-isocyanophenyl)-1-[2-(7-methoxyquinolin-4-yl)oxyethyl]pyridin-2-one
CID 59843024

Frequently Asked Questions

What is the IUPAC name of 2-[2-(7-methoxyquinolin-4-yl)oxyethyl]-6-phenylpyridazin-3-one?
The IUPAC name of 2-[2-(7-methoxyquinolin-4-yl)oxyethyl]-6-phenylpyridazin-3-one (CID 25016340) is 2-[2-(7-methoxyquinolin-4-yl)oxyethyl]-6-phenylpyridazin-3-one.
What is the SMILES notation for 2-[2-(7-methoxyquinolin-4-yl)oxyethyl]-6-phenylpyridazin-3-one?
The canonical SMILES for 2-[2-(7-methoxyquinolin-4-yl)oxyethyl]-6-phenylpyridazin-3-one is COc1ccc2c(OCCn3nc(-c4ccccc4)ccc3=O)ccnc2c1.
What is the InChIKey of 2-[2-(7-methoxyquinolin-4-yl)oxyethyl]-6-phenylpyridazin-3-one?
The InChIKey is REBSFDUDIWPZBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19N3O3/c1-27-17-7-8-18-20(15-17)23-12-11-21(18)28-14-13-25-22(26)10-9-19(24-25)16-5-3-2-4-6-16/h2-12,15H,13-14H2,1H3.
What are the key properties of 2-[2-(7-methoxyquinolin-4-yl)oxyethyl]-6-phenylpyridazin-3-one?
2-[2-(7-methoxyquinolin-4-yl)oxyethyl]-6-phenylpyridazin-3-one has a molecular weight of 373.41 g/mol, XLogP of 3.55, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(7-methoxyquinolin-4-yl)oxyethyl]-6-phenylpyridazin-3-one is sourced from PubChem (CID 25016340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).