ethane;4-methoxy-1H-pyridazin-6-one

C7H12N2O2 — CID 143928261

IUPACethane;4-methoxy-1H-pyridazin-6-one
SMILESCC.COc1cn[nH]c(=O)c1
InChIInChI=1S/C5H6N2O2.C2H6/c1-9-4-2-5(8)7-6-3-4;1-2/h2-3H,1H3,(H,7,8);1-2H3
InChIKeyZIVBLCJZCZJMPO-UHFFFAOYSA-N
MW156.18 g/mol
LogP0.80
Rot. Bonds1

About ethane;4-methoxy-1H-pyridazin-6-one

ethane;4-methoxy-1H-pyridazin-6-one (PubChem CID 143928261) has the molecular formula C7H12N2O2 and a molecular weight of 156.18 g/mol. Its IUPAC name is ethane;4-methoxy-1H-pyridazin-6-one.

Molecular Properties

Compound Nameethane;4-methoxy-1H-pyridazin-6-one
PubChem CID143928261
Molecular FormulaC7H12N2O2
Molecular Weight156.18 g/mol
Exact Mass156.09
IUPAC Nameethane;4-methoxy-1H-pyridazin-6-one
SMILESCC.COc1cn[nH]c(=O)c1
InChIInChI=1S/C5H6N2O2.C2H6/c1-9-4-2-5(8)7-6-3-4;1-2/h2-3H,1H3,(H,7,8);1-2H3
InChIKeyZIVBLCJZCZJMPO-UHFFFAOYSA-N
XLogP0.80
TPSA54.98 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.18
LogP ≤ 50.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of ethane;4-methoxy-1H-pyridazin-6-one?
The IUPAC name of ethane;4-methoxy-1H-pyridazin-6-one (CID 143928261) is ethane;4-methoxy-1H-pyridazin-6-one.
What is the SMILES notation for ethane;4-methoxy-1H-pyridazin-6-one?
The canonical SMILES for ethane;4-methoxy-1H-pyridazin-6-one is CC.COc1cn[nH]c(=O)c1.
What is the InChIKey of ethane;4-methoxy-1H-pyridazin-6-one?
The InChIKey is ZIVBLCJZCZJMPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6N2O2.C2H6/c1-9-4-2-5(8)7-6-3-4;1-2/h2-3H,1H3,(H,7,8);1-2H3.
What are the key properties of ethane;4-methoxy-1H-pyridazin-6-one?
ethane;4-methoxy-1H-pyridazin-6-one has a molecular weight of 156.18 g/mol, XLogP of 0.80, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;4-methoxy-1H-pyridazin-6-one is sourced from PubChem (CID 143928261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).