5-amino-4-ethyl-1H-pyridazin-6-one

C6H9N3O — CID 117127390

IUPAC5-amino-4-ethyl-1H-pyridazin-6-one
SMILESCCc1cn[nH]c(=O)c1N
InChIInChI=1S/C6H9N3O/c1-2-4-3-8-9-6(10)5(4)7/h3H,2H2,1H3,(H2,7,8)(H,9,10)
InChIKeyTYQNBQMIGDRLEE-UHFFFAOYSA-N
MW139.16 g/mol
LogP-0.09
Rot. Bonds1

About 5-amino-4-ethyl-1H-pyridazin-6-one

5-amino-4-ethyl-1H-pyridazin-6-one (PubChem CID 117127390) has the molecular formula C6H9N3O and a molecular weight of 139.16 g/mol. Its IUPAC name is 5-amino-4-ethyl-1H-pyridazin-6-one.

Molecular Properties

Compound Name5-amino-4-ethyl-1H-pyridazin-6-one
PubChem CID117127390
Molecular FormulaC6H9N3O
Molecular Weight139.16 g/mol
Exact Mass139.07
IUPAC Name5-amino-4-ethyl-1H-pyridazin-6-one
SMILESCCc1cn[nH]c(=O)c1N
InChIInChI=1S/C6H9N3O/c1-2-4-3-8-9-6(10)5(4)7/h3H,2H2,1H3,(H2,7,8)(H,9,10)
InChIKeyTYQNBQMIGDRLEE-UHFFFAOYSA-N
XLogP-0.09
TPSA71.77 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.16
LogP ≤ 5-0.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4,7-dihydro-3H-pyrido[2,3-d]pyridazin-8-one
CID 54197102
4-ethyl-5-methyl-1H-pyridazin-6-one
CID 21453493
4-acetyl-5-amino-1H-pyridazin-6-one
CID 68892644
5-amino-4-pentyl-1H-pyridazin-6-one
CID 69019844
5-amino-4-methyl-1H-pyridazin-6-one
CID 83680622
5-(butylideneamino)-4-methyl-1H-pyridazin-6-one
CID 126593740
5-ethanimidoyl-4-methyl-1H-pyridazin-6-one
CID 137200145
5-ethyl-4-methyl-1H-pyridazin-6-one
CID 141002393
5-amino-4-[(Z)-2-aminoprop-1-enyl]-1H-pyridazin-6-one
CID 145187944
5-amino-4-prop-2-enyl-1H-pyridazin-6-one
CID 174490166
5-amino-4-propyl-1H-pyridazin-6-one
CID 117127391
5-amino-4-(2-methylpropyl)-1H-pyridazin-6-one
CID 117127392

Frequently Asked Questions

What is the IUPAC name of 5-amino-4-ethyl-1H-pyridazin-6-one?
The IUPAC name of 5-amino-4-ethyl-1H-pyridazin-6-one (CID 117127390) is 5-amino-4-ethyl-1H-pyridazin-6-one.
What is the SMILES notation for 5-amino-4-ethyl-1H-pyridazin-6-one?
The canonical SMILES for 5-amino-4-ethyl-1H-pyridazin-6-one is CCc1cn[nH]c(=O)c1N.
What is the InChIKey of 5-amino-4-ethyl-1H-pyridazin-6-one?
The InChIKey is TYQNBQMIGDRLEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N3O/c1-2-4-3-8-9-6(10)5(4)7/h3H,2H2,1H3,(H2,7,8)(H,9,10).
What are the key properties of 5-amino-4-ethyl-1H-pyridazin-6-one?
5-amino-4-ethyl-1H-pyridazin-6-one has a molecular weight of 139.16 g/mol, XLogP of -0.09, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-4-ethyl-1H-pyridazin-6-one is sourced from PubChem (CID 117127390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).