2,4,6-triethylpyridazin-3-one

C10H16N2O — CID 90956249

IUPAC2,4,6-triethylpyridazin-3-one
SMILESCCc1cc(CC)c(=O)n(CC)n1
InChIInChI=1S/C10H16N2O/c1-4-8-7-9(5-2)11-12(6-3)10(8)13/h7H,4-6H2,1-3H3
InChIKeyBZYUQZWJZLDZNJ-UHFFFAOYSA-N
MW180.25 g/mol
LogP1.39
Rot. Bonds3

About 2,4,6-triethylpyridazin-3-one

2,4,6-triethylpyridazin-3-one (PubChem CID 90956249) has the molecular formula C10H16N2O and a molecular weight of 180.25 g/mol. Its IUPAC name is 2,4,6-triethylpyridazin-3-one.

Molecular Properties

Compound Name2,4,6-triethylpyridazin-3-one
PubChem CID90956249
Molecular FormulaC10H16N2O
Molecular Weight180.25 g/mol
Exact Mass180.13
IUPAC Name2,4,6-triethylpyridazin-3-one
SMILESCCc1cc(CC)c(=O)n(CC)n1
InChIInChI=1S/C10H16N2O/c1-4-8-7-9(5-2)11-12(6-3)10(8)13/h7H,4-6H2,1-3H3
InChIKeyBZYUQZWJZLDZNJ-UHFFFAOYSA-N
XLogP1.39
TPSA34.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 51.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

5,6-Dimethyl-2-(2-methylprop-2-enyl)-3-oxopyridazine-4-carbonitrile
CID 9380335
6-Methyl-2,4-di(propan-2-yl)pyridazin-3-one
CID 15054347
4-Methyl-2-propyl-6-(trifluoromethyl)pyridazin-3-one
CID 162611344
6-Methyl-2,4,5-tri(propan-2-yl)pyridazin-3-one
CID 15054348
2-Butyl-6-methylpyridazin-3-one
CID 12758398
4-Ethylidene-2,5-dimethylpyrazol-3-one
CID 22950815
4-Cyclohexa-2,5-dien-1-ylidene-5-methyl-2-propan-2-ylpyrazol-3-one
CID 23534330
6-Tert-butyl-2,4-dimethylpyridazin-3-one
CID 58499036
6-Chloro-2,4-di(propan-2-yl)pyridazin-3-one
CID 58567483
2,4,6-Trimethylpyridazin-3-one
CID 58694571
2,6-Di(propan-2-yl)pyridazin-3-one
CID 58748005
4,5,6-Trimethyl-2-propan-2-ylpyridazin-3-one
CID 58962214

Frequently Asked Questions

What is the IUPAC name of 2,4,6-triethylpyridazin-3-one?
The IUPAC name of 2,4,6-triethylpyridazin-3-one (CID 90956249) is 2,4,6-triethylpyridazin-3-one.
What is the SMILES notation for 2,4,6-triethylpyridazin-3-one?
The canonical SMILES for 2,4,6-triethylpyridazin-3-one is CCc1cc(CC)c(=O)n(CC)n1.
What is the InChIKey of 2,4,6-triethylpyridazin-3-one?
The InChIKey is BZYUQZWJZLDZNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O/c1-4-8-7-9(5-2)11-12(6-3)10(8)13/h7H,4-6H2,1-3H3.
What are the key properties of 2,4,6-triethylpyridazin-3-one?
2,4,6-triethylpyridazin-3-one has a molecular weight of 180.25 g/mol, XLogP of 1.39, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4,6-triethylpyridazin-3-one is sourced from PubChem (CID 90956249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).