6-[2-(diethylamino)ethoxy]-2-methylpyridazin-3-one

C11H19N3O2 — CID 12015112

IUPAC6-[2-(diethylamino)ethoxy]-2-methylpyridazin-3-one
SMILESCCN(CC)CCOc1ccc(=O)n(C)n1
InChIInChI=1S/C11H19N3O2/c1-4-14(5-2)8-9-16-10-6-7-11(15)13(3)12-10/h6-7H,4-5,8-9H2,1-3H3
InChIKeyDWUASBFQTSPVQZ-UHFFFAOYSA-N
MW225.29 g/mol
LogP0.50
Rot. Bonds6

About 6-[2-(diethylamino)ethoxy]-2-methylpyridazin-3-one

6-[2-(diethylamino)ethoxy]-2-methylpyridazin-3-one (PubChem CID 12015112) has the molecular formula C11H19N3O2 and a molecular weight of 225.29 g/mol. Its IUPAC name is 6-[2-(diethylamino)ethoxy]-2-methylpyridazin-3-one.

Molecular Properties

Compound Name6-[2-(diethylamino)ethoxy]-2-methylpyridazin-3-one
PubChem CID12015112
Molecular FormulaC11H19N3O2
Molecular Weight225.29 g/mol
Exact Mass225.15
IUPAC Name6-[2-(diethylamino)ethoxy]-2-methylpyridazin-3-one
SMILESCCN(CC)CCOc1ccc(=O)n(C)n1
InChIInChI=1S/C11H19N3O2/c1-4-14(5-2)8-9-16-10-6-7-11(15)13(3)12-10/h6-7H,4-5,8-9H2,1-3H3
InChIKeyDWUASBFQTSPVQZ-UHFFFAOYSA-N
XLogP0.50
TPSA47.36 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.29
LogP ≤ 50.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-[2-(diethylamino)ethoxy]-2-methylpyridazin-3-one?
The IUPAC name of 6-[2-(diethylamino)ethoxy]-2-methylpyridazin-3-one (CID 12015112) is 6-[2-(diethylamino)ethoxy]-2-methylpyridazin-3-one.
What is the SMILES notation for 6-[2-(diethylamino)ethoxy]-2-methylpyridazin-3-one?
The canonical SMILES for 6-[2-(diethylamino)ethoxy]-2-methylpyridazin-3-one is CCN(CC)CCOc1ccc(=O)n(C)n1.
What is the InChIKey of 6-[2-(diethylamino)ethoxy]-2-methylpyridazin-3-one?
The InChIKey is DWUASBFQTSPVQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O2/c1-4-14(5-2)8-9-16-10-6-7-11(15)13(3)12-10/h6-7H,4-5,8-9H2,1-3H3.
What are the key properties of 6-[2-(diethylamino)ethoxy]-2-methylpyridazin-3-one?
6-[2-(diethylamino)ethoxy]-2-methylpyridazin-3-one has a molecular weight of 225.29 g/mol, XLogP of 0.50, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-(diethylamino)ethoxy]-2-methylpyridazin-3-one is sourced from PubChem (CID 12015112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).