5-[ethyl(methyl)amino]-2-(2-hydroxy-3-methoxypropyl)pyridazin-3-one

C11H19N3O3 — CID 104920957

IUPAC5-[ethyl(methyl)amino]-2-(2-hydroxy-3-methoxypropyl)pyridazin-3-one
SMILESCCN(C)c1cnn(CC(O)COC)c(=O)c1
InChIInChI=1S/C11H19N3O3/c1-4-13(2)9-5-11(16)14(12-6-9)7-10(15)8-17-3/h5-6,10,15H,4,7-8H2,1-3H3
InChIKeyOYVDQWYOUTYCIB-UHFFFAOYSA-N
MW241.29 g/mol
LogP-0.29
Rot. Bonds6

About 5-[ethyl(methyl)amino]-2-(2-hydroxy-3-methoxypropyl)pyridazin-3-one

5-[ethyl(methyl)amino]-2-(2-hydroxy-3-methoxypropyl)pyridazin-3-one (PubChem CID 104920957) has the molecular formula C11H19N3O3 and a molecular weight of 241.29 g/mol. Its IUPAC name is 5-[ethyl(methyl)amino]-2-(2-hydroxy-3-methoxypropyl)pyridazin-3-one.

Molecular Properties

Compound Name5-[ethyl(methyl)amino]-2-(2-hydroxy-3-methoxypropyl)pyridazin-3-one
PubChem CID104920957
Molecular FormulaC11H19N3O3
Molecular Weight241.29 g/mol
Exact Mass241.14
IUPAC Name5-[ethyl(methyl)amino]-2-(2-hydroxy-3-methoxypropyl)pyridazin-3-one
SMILESCCN(C)c1cnn(CC(O)COC)c(=O)c1
InChIInChI=1S/C11H19N3O3/c1-4-13(2)9-5-11(16)14(12-6-9)7-10(15)8-17-3/h5-6,10,15H,4,7-8H2,1-3H3
InChIKeyOYVDQWYOUTYCIB-UHFFFAOYSA-N
XLogP-0.29
TPSA67.59 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 5-0.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-[ethyl(methyl)amino]-2-(2-hydroxy-3-methoxypropyl)pyridazin-3-one?
The IUPAC name of 5-[ethyl(methyl)amino]-2-(2-hydroxy-3-methoxypropyl)pyridazin-3-one (CID 104920957) is 5-[ethyl(methyl)amino]-2-(2-hydroxy-3-methoxypropyl)pyridazin-3-one.
What is the SMILES notation for 5-[ethyl(methyl)amino]-2-(2-hydroxy-3-methoxypropyl)pyridazin-3-one?
The canonical SMILES for 5-[ethyl(methyl)amino]-2-(2-hydroxy-3-methoxypropyl)pyridazin-3-one is CCN(C)c1cnn(CC(O)COC)c(=O)c1.
What is the InChIKey of 5-[ethyl(methyl)amino]-2-(2-hydroxy-3-methoxypropyl)pyridazin-3-one?
The InChIKey is OYVDQWYOUTYCIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O3/c1-4-13(2)9-5-11(16)14(12-6-9)7-10(15)8-17-3/h5-6,10,15H,4,7-8H2,1-3H3.
What are the key properties of 5-[ethyl(methyl)amino]-2-(2-hydroxy-3-methoxypropyl)pyridazin-3-one?
5-[ethyl(methyl)amino]-2-(2-hydroxy-3-methoxypropyl)pyridazin-3-one has a molecular weight of 241.29 g/mol, XLogP of -0.29, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[ethyl(methyl)amino]-2-(2-hydroxy-3-methoxypropyl)pyridazin-3-one is sourced from PubChem (CID 104920957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).