6-methyl-4-oxo-1-(2,4,6-trimethylphenyl)pyridazine-3-carbohydrazide

C15H18N4O2 — CID 82420147

IUPAC6-methyl-4-oxo-1-(2,4,6-trimethylphenyl)pyridazine-3-carbohydrazide
SMILESCc1cc(C)c(-n2nc(C(=O)NN)c(=O)cc2C)c(C)c1
InChIInChI=1S/C15H18N4O2/c1-8-5-9(2)14(10(3)6-8)19-11(4)7-12(20)13(18-19)15(21)17-16/h5-7H,16H2,1-4H3,(H,17,21)
InChIKeyPGEPDCWEAOHMML-UHFFFAOYSA-N
MW286.34 g/mol
LogP1.07
Rot. Bonds2

About 6-methyl-4-oxo-1-(2,4,6-trimethylphenyl)pyridazine-3-carbohydrazide

6-methyl-4-oxo-1-(2,4,6-trimethylphenyl)pyridazine-3-carbohydrazide (PubChem CID 82420147) has the molecular formula C15H18N4O2 and a molecular weight of 286.34 g/mol. Its IUPAC name is 6-methyl-4-oxo-1-(2,4,6-trimethylphenyl)pyridazine-3-carbohydrazide.

Molecular Properties

Compound Name6-methyl-4-oxo-1-(2,4,6-trimethylphenyl)pyridazine-3-carbohydrazide
PubChem CID82420147
Molecular FormulaC15H18N4O2
Molecular Weight286.34 g/mol
Exact Mass286.14
IUPAC Name6-methyl-4-oxo-1-(2,4,6-trimethylphenyl)pyridazine-3-carbohydrazide
SMILESCc1cc(C)c(-n2nc(C(=O)NN)c(=O)cc2C)c(C)c1
InChIInChI=1S/C15H18N4O2/c1-8-5-9(2)14(10(3)6-8)19-11(4)7-12(20)13(18-19)15(21)17-16/h5-7H,16H2,1-4H3,(H,17,21)
InChIKeyPGEPDCWEAOHMML-UHFFFAOYSA-N
XLogP1.07
TPSA90.01 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.34
LogP ≤ 51.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

3-amino-6-methyl-1-(2,4,6-trimethylphenyl)pyridazin-4-one
CID 82467314
1-(4-ethoxyphenyl)-6-methyl-4-oxopyridazine-3-carbohydrazide
CID 82420049
6-methyl-4-oxo-1-[3-(trifluoromethyl)phenyl]pyridazine-3-carbohydrazide
CID 167743128
1-(2,6-dimethylphenyl)-6-methyl-4-oxopyridazine-3-carbothioamide
CID 82420278
1-(2,4-dimethylphenyl)-4-hydroxy-6-oxopyridazine-3-carbohydrazide
CID 82419192
methyl 5-methyl-1-(2,4,6-trimethylphenyl)pyrazole-3-carboxylate
CID 55120572
1-(2-fluorophenyl)-6-methyl-4-oxo-N-(2,4,6-trimethylphenyl)pyridazine-3-carboxamide
CID 26687881
N-(3-aminopropyl)-6-methyl-4-oxo-1-phenylpyridazine-3-carboxamide;hydrochloride
CID 119406647
6-(aminomethyl)-5-hydroxy-2-(2,4,6-trimethylphenyl)pyridazin-3-one
CID 82420094
6-methyl-4-oxo-1-(2,4,6-tribromophenyl)pyridazine-3-carboxylic acid
CID 43154907
N-[2-(ethylamino)-2-oxoethyl]-6-methyl-4-oxo-1-phenylpyridazine-3-carboxamide
CID 86909633
methyl 4-bromo-5-methyl-1-(2,4,6-trimethylphenyl)pyrazole-3-carboxylate
CID 62795457

Frequently Asked Questions

What is the IUPAC name of 6-methyl-4-oxo-1-(2,4,6-trimethylphenyl)pyridazine-3-carbohydrazide?
The IUPAC name of 6-methyl-4-oxo-1-(2,4,6-trimethylphenyl)pyridazine-3-carbohydrazide (CID 82420147) is 6-methyl-4-oxo-1-(2,4,6-trimethylphenyl)pyridazine-3-carbohydrazide.
What is the SMILES notation for 6-methyl-4-oxo-1-(2,4,6-trimethylphenyl)pyridazine-3-carbohydrazide?
The canonical SMILES for 6-methyl-4-oxo-1-(2,4,6-trimethylphenyl)pyridazine-3-carbohydrazide is Cc1cc(C)c(-n2nc(C(=O)NN)c(=O)cc2C)c(C)c1.
What is the InChIKey of 6-methyl-4-oxo-1-(2,4,6-trimethylphenyl)pyridazine-3-carbohydrazide?
The InChIKey is PGEPDCWEAOHMML-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O2/c1-8-5-9(2)14(10(3)6-8)19-11(4)7-12(20)13(18-19)15(21)17-16/h5-7H,16H2,1-4H3,(H,17,21).
What are the key properties of 6-methyl-4-oxo-1-(2,4,6-trimethylphenyl)pyridazine-3-carbohydrazide?
6-methyl-4-oxo-1-(2,4,6-trimethylphenyl)pyridazine-3-carbohydrazide has a molecular weight of 286.34 g/mol, XLogP of 1.07, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-4-oxo-1-(2,4,6-trimethylphenyl)pyridazine-3-carbohydrazide is sourced from PubChem (CID 82420147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).