2-amino-5-methylpyridazin-3-one;ethane

C7H13N3O — CID 144623537

IUPAC2-amino-5-methylpyridazin-3-one;ethane
SMILESCC.Cc1cnn(N)c(=O)c1
InChIInChI=1S/C5H7N3O.C2H6/c1-4-2-5(9)8(6)7-3-4;1-2/h2-3H,6H2,1H3;1-2H3
InChIKeyMASDOEPMQBRAFP-UHFFFAOYSA-N
MW155.20 g/mol
LogP0.29
Rot. Bonds

About 2-amino-5-methylpyridazin-3-one;ethane

2-amino-5-methylpyridazin-3-one;ethane (PubChem CID 144623537) has the molecular formula C7H13N3O and a molecular weight of 155.20 g/mol. Its IUPAC name is 2-amino-5-methylpyridazin-3-one;ethane.

Molecular Properties

Compound Name2-amino-5-methylpyridazin-3-one;ethane
PubChem CID144623537
Molecular FormulaC7H13N3O
Molecular Weight155.20 g/mol
Exact Mass155.11
IUPAC Name2-amino-5-methylpyridazin-3-one;ethane
SMILESCC.Cc1cnn(N)c(=O)c1
InChIInChI=1S/C5H7N3O.C2H6/c1-4-2-5(9)8(6)7-3-4;1-2/h2-3H,6H2,1H3;1-2H3
InChIKeyMASDOEPMQBRAFP-UHFFFAOYSA-N
XLogP0.29
TPSA60.91 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.20
LogP ≤ 50.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-amino-5-methylpyridazin-3-one;ethane?
The IUPAC name of 2-amino-5-methylpyridazin-3-one;ethane (CID 144623537) is 2-amino-5-methylpyridazin-3-one;ethane.
What is the SMILES notation for 2-amino-5-methylpyridazin-3-one;ethane?
The canonical SMILES for 2-amino-5-methylpyridazin-3-one;ethane is CC.Cc1cnn(N)c(=O)c1.
What is the InChIKey of 2-amino-5-methylpyridazin-3-one;ethane?
The InChIKey is MASDOEPMQBRAFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7N3O.C2H6/c1-4-2-5(9)8(6)7-3-4;1-2/h2-3H,6H2,1H3;1-2H3.
What are the key properties of 2-amino-5-methylpyridazin-3-one;ethane?
2-amino-5-methylpyridazin-3-one;ethane has a molecular weight of 155.20 g/mol, XLogP of 0.29, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-methylpyridazin-3-one;ethane is sourced from PubChem (CID 144623537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).