4-[ethyl(methyl)amino]-6-(3-methoxyphenyl)-2-(2-methyl-5-morpholin-4-ylphenyl)pyridazin-3-one

C25H30N4O3 — CID 69161328

IUPAC4-[ethyl(methyl)amino]-6-(3-methoxyphenyl)-2-(2-methyl-5-morpholin-4-ylphenyl)pyridazin-3-one
SMILESCCN(C)c1cc(-c2cccc(OC)c2)nn(-c2cc(N3CCOCC3)ccc2C)c1=O
InChIInChI=1S/C25H30N4O3/c1-5-27(3)24-17-22(19-7-6-8-21(15-19)31-4)26-29(25(24)30)23-16-20(10-9-18(23)2)28-11-13-32-14-12-28/h6-10,15-17H,5,11-14H2,1-4H3
InChIKeyOQHPSYFBUOACFN-UHFFFAOYSA-N
MW434.54 g/mol
LogP3.51
Rot. Bonds6

About 4-[ethyl(methyl)amino]-6-(3-methoxyphenyl)-2-(2-methyl-5-morpholin-4-ylphenyl)pyridazin-3-one

4-[ethyl(methyl)amino]-6-(3-methoxyphenyl)-2-(2-methyl-5-morpholin-4-ylphenyl)pyridazin-3-one (PubChem CID 69161328) has the molecular formula C25H30N4O3 and a molecular weight of 434.54 g/mol. Its IUPAC name is 4-[ethyl(methyl)amino]-6-(3-methoxyphenyl)-2-(2-methyl-5-morpholin-4-ylphenyl)pyridazin-3-one.

Molecular Properties

Compound Name4-[ethyl(methyl)amino]-6-(3-methoxyphenyl)-2-(2-methyl-5-morpholin-4-ylphenyl)pyridazin-3-one
PubChem CID69161328
Molecular FormulaC25H30N4O3
Molecular Weight434.54 g/mol
Exact Mass434.23
IUPAC Name4-[ethyl(methyl)amino]-6-(3-methoxyphenyl)-2-(2-methyl-5-morpholin-4-ylphenyl)pyridazin-3-one
SMILESCCN(C)c1cc(-c2cccc(OC)c2)nn(-c2cc(N3CCOCC3)ccc2C)c1=O
InChIInChI=1S/C25H30N4O3/c1-5-27(3)24-17-22(19-7-6-8-21(15-19)31-4)26-29(25(24)30)23-16-20(10-9-18(23)2)28-11-13-32-14-12-28/h6-10,15-17H,5,11-14H2,1-4H3
InChIKeyOQHPSYFBUOACFN-UHFFFAOYSA-N
XLogP3.51
TPSA59.83 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500434.54
LogP ≤ 53.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 4-[ethyl(methyl)amino]-6-(3-methoxyphenyl)-2-(2-methyl-5-morpholin-4-ylphenyl)pyridazin-3-one?
The IUPAC name of 4-[ethyl(methyl)amino]-6-(3-methoxyphenyl)-2-(2-methyl-5-morpholin-4-ylphenyl)pyridazin-3-one (CID 69161328) is 4-[ethyl(methyl)amino]-6-(3-methoxyphenyl)-2-(2-methyl-5-morpholin-4-ylphenyl)pyridazin-3-one.
What is the SMILES notation for 4-[ethyl(methyl)amino]-6-(3-methoxyphenyl)-2-(2-methyl-5-morpholin-4-ylphenyl)pyridazin-3-one?
The canonical SMILES for 4-[ethyl(methyl)amino]-6-(3-methoxyphenyl)-2-(2-methyl-5-morpholin-4-ylphenyl)pyridazin-3-one is CCN(C)c1cc(-c2cccc(OC)c2)nn(-c2cc(N3CCOCC3)ccc2C)c1=O.
What is the InChIKey of 4-[ethyl(methyl)amino]-6-(3-methoxyphenyl)-2-(2-methyl-5-morpholin-4-ylphenyl)pyridazin-3-one?
The InChIKey is OQHPSYFBUOACFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H30N4O3/c1-5-27(3)24-17-22(19-7-6-8-21(15-19)31-4)26-29(25(24)30)23-16-20(10-9-18(23)2)28-11-13-32-14-12-28/h6-10,15-17H,5,11-14H2,1-4H3.
What are the key properties of 4-[ethyl(methyl)amino]-6-(3-methoxyphenyl)-2-(2-methyl-5-morpholin-4-ylphenyl)pyridazin-3-one?
4-[ethyl(methyl)amino]-6-(3-methoxyphenyl)-2-(2-methyl-5-morpholin-4-ylphenyl)pyridazin-3-one has a molecular weight of 434.54 g/mol, XLogP of 3.51, 6 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[ethyl(methyl)amino]-6-(3-methoxyphenyl)-2-(2-methyl-5-morpholin-4-ylphenyl)pyridazin-3-one is sourced from PubChem (CID 69161328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).