4,5-diethyl-1,2-dimethylpyridazine-3,6-dione

C10H16N2O2 — CID 118408753

IUPAC4,5-diethyl-1,2-dimethylpyridazine-3,6-dione
SMILESCCc1c(CC)c(=O)n(C)n(C)c1=O
InChIInChI=1S/C10H16N2O2/c1-5-7-8(6-2)10(14)12(4)11(3)9(7)13/h5-6H2,1-4H3
InChIKeyAUIFSJGXBMLLSI-UHFFFAOYSA-N
MW196.25 g/mol
LogP0.21
Rot. Bonds2

About 4,5-diethyl-1,2-dimethylpyridazine-3,6-dione

4,5-diethyl-1,2-dimethylpyridazine-3,6-dione (PubChem CID 118408753) has the molecular formula C10H16N2O2 and a molecular weight of 196.25 g/mol. Its IUPAC name is 4,5-diethyl-1,2-dimethylpyridazine-3,6-dione.

Molecular Properties

Compound Name4,5-diethyl-1,2-dimethylpyridazine-3,6-dione
PubChem CID118408753
Molecular FormulaC10H16N2O2
Molecular Weight196.25 g/mol
Exact Mass196.12
IUPAC Name4,5-diethyl-1,2-dimethylpyridazine-3,6-dione
SMILESCCc1c(CC)c(=O)n(C)n(C)c1=O
InChIInChI=1S/C10H16N2O2/c1-5-7-8(6-2)10(14)12(4)11(3)9(7)13/h5-6H2,1-4H3
InChIKeyAUIFSJGXBMLLSI-UHFFFAOYSA-N
XLogP0.21
TPSA44.00 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 50.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 4,5-diethyl-1,2-dimethylpyridazine-3,6-dione with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4,5-Ditert-butyl-1,2-dimethylpyridazine-3,6-dione
CID 20871956
2-butyl-4,5-ditert-butyl-1-methyl-3H-pyridazin-6-one
CID 20871968
4,5-ditert-butyl-1,2-dimethyl-3H-pyridazin-6-one
CID 23402512
1-Butyl-4,5-ditert-butyl-2-methylpyridazine-3,6-dione
CID 23402538
4,5-Ditert-butyl-1-methyl-2-propylpyridazine-3,6-dione
CID 23552335
4,5-ditert-butyl-1-methyl-2-propyl-3H-pyridazin-6-one
CID 23552379
4,5-ditert-butyl-2-methyl-1H-pyridazine-3,6-dione
CID 23592090
1,2,4,5-Tetramethylpyridazine-3,6-dione
CID 89628781
N-(5-cyano-4-methyl-2,6-dioxo-3H-pyridin-1-yl)-N,2,2-trimethylpropanamide
CID 90207927
1-(dibutylamino)-4,5-dimethyl-3H-pyridine-2,6-dione
CID 90207973
1-(dimethylamino)-4,5-dimethyl-3H-pyridine-2,6-dione
CID 90207977
(Z)-N,2,3-trimethylpent-2-enehydrazide
CID 163742712

Frequently Asked Questions

What is the IUPAC name of 4,5-diethyl-1,2-dimethylpyridazine-3,6-dione?
The IUPAC name of 4,5-diethyl-1,2-dimethylpyridazine-3,6-dione (CID 118408753) is 4,5-diethyl-1,2-dimethylpyridazine-3,6-dione.
What is the SMILES notation for 4,5-diethyl-1,2-dimethylpyridazine-3,6-dione?
The canonical SMILES for 4,5-diethyl-1,2-dimethylpyridazine-3,6-dione is CCc1c(CC)c(=O)n(C)n(C)c1=O.
What is the InChIKey of 4,5-diethyl-1,2-dimethylpyridazine-3,6-dione?
The InChIKey is AUIFSJGXBMLLSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O2/c1-5-7-8(6-2)10(14)12(4)11(3)9(7)13/h5-6H2,1-4H3.
What are the key properties of 4,5-diethyl-1,2-dimethylpyridazine-3,6-dione?
4,5-diethyl-1,2-dimethylpyridazine-3,6-dione has a molecular weight of 196.25 g/mol, XLogP of 0.21, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5-diethyl-1,2-dimethylpyridazine-3,6-dione is sourced from PubChem (CID 118408753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).