2-ethyl-5-(methylamino)pyridazin-3-one

C7H11N3O — CID 103218572

IUPAC2-ethyl-5-(methylamino)pyridazin-3-one
SMILESCCn1ncc(NC)cc1=O
InChIInChI=1S/C7H11N3O/c1-3-10-7(11)4-6(8-2)5-9-10/h4-5,8H,3H2,1-2H3
InChIKeyJXQUFLZBKRWRNR-UHFFFAOYSA-N
MW153.19 g/mol
LogP0.30
Rot. Bonds2

About 2-ethyl-5-(methylamino)pyridazin-3-one

2-ethyl-5-(methylamino)pyridazin-3-one (PubChem CID 103218572) has the molecular formula C7H11N3O and a molecular weight of 153.19 g/mol. Its IUPAC name is 2-ethyl-5-(methylamino)pyridazin-3-one.

Molecular Properties

Compound Name2-ethyl-5-(methylamino)pyridazin-3-one
PubChem CID103218572
Molecular FormulaC7H11N3O
Molecular Weight153.19 g/mol
Exact Mass153.09
IUPAC Name2-ethyl-5-(methylamino)pyridazin-3-one
SMILESCCn1ncc(NC)cc1=O
InChIInChI=1S/C7H11N3O/c1-3-10-7(11)4-6(8-2)5-9-10/h4-5,8H,3H2,1-2H3
InChIKeyJXQUFLZBKRWRNR-UHFFFAOYSA-N
XLogP0.30
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.19
LogP ≤ 50.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-5-(methylamino)pyridazin-3-one?
The IUPAC name of 2-ethyl-5-(methylamino)pyridazin-3-one (CID 103218572) is 2-ethyl-5-(methylamino)pyridazin-3-one.
What is the SMILES notation for 2-ethyl-5-(methylamino)pyridazin-3-one?
The canonical SMILES for 2-ethyl-5-(methylamino)pyridazin-3-one is CCn1ncc(NC)cc1=O.
What is the InChIKey of 2-ethyl-5-(methylamino)pyridazin-3-one?
The InChIKey is JXQUFLZBKRWRNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3O/c1-3-10-7(11)4-6(8-2)5-9-10/h4-5,8H,3H2,1-2H3.
What are the key properties of 2-ethyl-5-(methylamino)pyridazin-3-one?
2-ethyl-5-(methylamino)pyridazin-3-one has a molecular weight of 153.19 g/mol, XLogP of 0.30, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-5-(methylamino)pyridazin-3-one is sourced from PubChem (CID 103218572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).