1-methyl-N-(2-methylprop-2-enyl)-6-oxo-4,5-dihydropyridazine-3-carboxamide

C10H15N3O2 — CID 114618304

IUPAC1-methyl-N-(2-methylprop-2-enyl)-6-oxo-4,5-dihydropyridazine-3-carboxamide
SMILESC=C(C)CNC(=O)C1=NN(C)C(=O)CC1
InChIInChI=1S/C10H15N3O2/c1-7(2)6-11-10(15)8-4-5-9(14)13(3)12-8/h1,4-6H2,2-3H3,(H,11,15)
InChIKeyLGAWWIRAVHMJSQ-UHFFFAOYSA-N
MW209.25 g/mol
LogP0.29
Rot. Bonds3

About 1-methyl-N-(2-methylprop-2-enyl)-6-oxo-4,5-dihydropyridazine-3-carboxamide

1-methyl-N-(2-methylprop-2-enyl)-6-oxo-4,5-dihydropyridazine-3-carboxamide (PubChem CID 114618304) has the molecular formula C10H15N3O2 and a molecular weight of 209.25 g/mol. Its IUPAC name is 1-methyl-N-(2-methylprop-2-enyl)-6-oxo-4,5-dihydropyridazine-3-carboxamide.

Molecular Properties

Compound Name1-methyl-N-(2-methylprop-2-enyl)-6-oxo-4,5-dihydropyridazine-3-carboxamide
PubChem CID114618304
Molecular FormulaC10H15N3O2
Molecular Weight209.25 g/mol
Exact Mass209.12
IUPAC Name1-methyl-N-(2-methylprop-2-enyl)-6-oxo-4,5-dihydropyridazine-3-carboxamide
SMILESC=C(C)CNC(=O)C1=NN(C)C(=O)CC1
InChIInChI=1S/C10H15N3O2/c1-7(2)6-11-10(15)8-4-5-9(14)13(3)12-8/h1,4-6H2,2-3H3,(H,11,15)
InChIKeyLGAWWIRAVHMJSQ-UHFFFAOYSA-N
XLogP0.29
TPSA61.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 50.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze 1-methyl-N-(2-methylprop-2-enyl)-6-oxo-4,5-dihydropyridazine-3-carboxamide 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

1-methyl-6-oxo-N-propyl-4,5-dihydropyridazine-3-carboxamide
CID 47014189
3-[(1-methyl-6-oxo-4,5-dihydropyridazine-3-carbonyl)amino]propanoic acid
CID 43170671
1-methyl-6-oxo-N-pentyl-4,5-dihydropyridazine-3-carboxamide
CID 30384665
N-ethyl-1-methyl-N-(2-methylprop-2-enyl)-6-oxo-4,5-dihydropyridazine-3-carboxamide
CID 51075316
N-[[1-(hydroxymethyl)cyclohexyl]methyl]-1-methyl-6-oxo-4,5-dihydropyridazine-3-carboxamide
CID 115701209
N-(2-hydroxy-2-methylpentyl)-1-methyl-6-oxo-4,5-dihydropyridazine-3-carboxamide
CID 113246026
2-methyl-4-[(1-methyl-6-oxo-4,5-dihydropyridazine-3-carbonyl)amino]butanoic acid
CID 80539041
1-methyl-6-oxo-N-(2-phenylethyl)-4,5-dihydropyridazine-3-carboxamide
CID 24540154
2-methoxy-3-[(1-methyl-6-oxo-4,5-dihydropyridazine-3-carbonyl)amino]propanoic acid
CID 106107690
1-methyl-N-(2-methyl-2-piperidin-1-ylpropyl)-6-oxo-4,5-dihydropyridazine-3-carboxamide
CID 51074223
4,4-dimethyl-2-[[(1-methyl-6-oxo-4,5-dihydropyridazine-3-carbonyl)amino]methyl]pentanoic acid
CID 107473792
1-methyl-N-[2-(2-methylphenyl)ethyl]-6-oxo-4,5-dihydropyridazine-3-carboxamide
CID 24547280

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-(2-methylprop-2-enyl)-6-oxo-4,5-dihydropyridazine-3-carboxamide?
The IUPAC name of 1-methyl-N-(2-methylprop-2-enyl)-6-oxo-4,5-dihydropyridazine-3-carboxamide (CID 114618304) is 1-methyl-N-(2-methylprop-2-enyl)-6-oxo-4,5-dihydropyridazine-3-carboxamide.
What is the SMILES notation for 1-methyl-N-(2-methylprop-2-enyl)-6-oxo-4,5-dihydropyridazine-3-carboxamide?
The canonical SMILES for 1-methyl-N-(2-methylprop-2-enyl)-6-oxo-4,5-dihydropyridazine-3-carboxamide is C=C(C)CNC(=O)C1=NN(C)C(=O)CC1.
What is the InChIKey of 1-methyl-N-(2-methylprop-2-enyl)-6-oxo-4,5-dihydropyridazine-3-carboxamide?
The InChIKey is LGAWWIRAVHMJSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O2/c1-7(2)6-11-10(15)8-4-5-9(14)13(3)12-8/h1,4-6H2,2-3H3,(H,11,15).
What are the key properties of 1-methyl-N-(2-methylprop-2-enyl)-6-oxo-4,5-dihydropyridazine-3-carboxamide?
1-methyl-N-(2-methylprop-2-enyl)-6-oxo-4,5-dihydropyridazine-3-carboxamide has a molecular weight of 209.25 g/mol, XLogP of 0.29, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-(2-methylprop-2-enyl)-6-oxo-4,5-dihydropyridazine-3-carboxamide is sourced from PubChem (CID 114618304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).