2,4-diethyl-6-propyl-4,5-dihydropyridazin-3-one

C11H20N2O — CID 58694575

IUPAC2,4-diethyl-6-propyl-4,5-dihydropyridazin-3-one
SMILESCCCC1=NN(CC)C(=O)C(CC)C1
InChIInChI=1S/C11H20N2O/c1-4-7-10-8-9(5-2)11(14)13(6-3)12-10/h9H,4-8H2,1-3H3
InChIKeyNPOQKLFTMLYBGO-UHFFFAOYSA-N
MW196.29 g/mol
LogP2.42
Rot. Bonds4

About 2,4-diethyl-6-propyl-4,5-dihydropyridazin-3-one

2,4-diethyl-6-propyl-4,5-dihydropyridazin-3-one (PubChem CID 58694575) has the molecular formula C11H20N2O and a molecular weight of 196.29 g/mol. Its IUPAC name is 2,4-diethyl-6-propyl-4,5-dihydropyridazin-3-one.

Molecular Properties

Compound Name2,4-diethyl-6-propyl-4,5-dihydropyridazin-3-one
PubChem CID58694575
Molecular FormulaC11H20N2O
Molecular Weight196.29 g/mol
Exact Mass196.16
IUPAC Name2,4-diethyl-6-propyl-4,5-dihydropyridazin-3-one
SMILESCCCC1=NN(CC)C(=O)C(CC)C1
InChIInChI=1S/C11H20N2O/c1-4-7-10-8-9(5-2)11(14)13(6-3)12-10/h9H,4-8H2,1-3H3
InChIKeyNPOQKLFTMLYBGO-UHFFFAOYSA-N
XLogP2.42
TPSA32.67 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.29
LogP ≤ 52.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,4-diethyl-6-propyl-4,5-dihydropyridazin-3-one?
The IUPAC name of 2,4-diethyl-6-propyl-4,5-dihydropyridazin-3-one (CID 58694575) is 2,4-diethyl-6-propyl-4,5-dihydropyridazin-3-one.
What is the SMILES notation for 2,4-diethyl-6-propyl-4,5-dihydropyridazin-3-one?
The canonical SMILES for 2,4-diethyl-6-propyl-4,5-dihydropyridazin-3-one is CCCC1=NN(CC)C(=O)C(CC)C1.
What is the InChIKey of 2,4-diethyl-6-propyl-4,5-dihydropyridazin-3-one?
The InChIKey is NPOQKLFTMLYBGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O/c1-4-7-10-8-9(5-2)11(14)13(6-3)12-10/h9H,4-8H2,1-3H3.
What are the key properties of 2,4-diethyl-6-propyl-4,5-dihydropyridazin-3-one?
2,4-diethyl-6-propyl-4,5-dihydropyridazin-3-one has a molecular weight of 196.29 g/mol, XLogP of 2.42, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-diethyl-6-propyl-4,5-dihydropyridazin-3-one is sourced from PubChem (CID 58694575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).