N,4-dimethoxy-N-methyl-1-(3-methylphenyl)-6-oxopyridazine-3-carboxamide

C15H17N3O4 — CID 58072218

IUPACN,4-dimethoxy-N-methyl-1-(3-methylphenyl)-6-oxopyridazine-3-carboxamide
SMILESCOc1cc(=O)n(-c2cccc(C)c2)nc1C(=O)N(C)OC
InChIInChI=1S/C15H17N3O4/c1-10-6-5-7-11(8-10)18-13(19)9-12(21-3)14(16-18)15(20)17(2)22-4/h5-9H,1-4H3
InChIKeyYZLAKMKCOJJABR-UHFFFAOYSA-N
MW303.32 g/mol
LogP1.18
Rot. Bonds4

About N,4-dimethoxy-N-methyl-1-(3-methylphenyl)-6-oxopyridazine-3-carboxamide

N,4-dimethoxy-N-methyl-1-(3-methylphenyl)-6-oxopyridazine-3-carboxamide (PubChem CID 58072218) has the molecular formula C15H17N3O4 and a molecular weight of 303.32 g/mol. Its IUPAC name is N,4-dimethoxy-N-methyl-1-(3-methylphenyl)-6-oxopyridazine-3-carboxamide.

Molecular Properties

Compound NameN,4-dimethoxy-N-methyl-1-(3-methylphenyl)-6-oxopyridazine-3-carboxamide
PubChem CID58072218
Molecular FormulaC15H17N3O4
Molecular Weight303.32 g/mol
Exact Mass303.12
IUPAC NameN,4-dimethoxy-N-methyl-1-(3-methylphenyl)-6-oxopyridazine-3-carboxamide
SMILESCOc1cc(=O)n(-c2cccc(C)c2)nc1C(=O)N(C)OC
InChIInChI=1S/C15H17N3O4/c1-10-6-5-7-11(8-10)18-13(19)9-12(21-3)14(16-18)15(20)17(2)22-4/h5-9H,1-4H3
InChIKeyYZLAKMKCOJJABR-UHFFFAOYSA-N
XLogP1.18
TPSA73.66 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.32
LogP ≤ 51.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze N,4-dimethoxy-N-methyl-1-(3-methylphenyl)-6-oxopyridazine-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

N,4-dimethoxy-N,1-dimethyl-6-oxopyridazine-3-carboxamide
CID 58072435
4-methoxy-N,N-bis(2-methylpropyl)-6-oxo-1-phenylpyridazine-3-carboxamide
CID 8554268
ethyl 1-(3-bromophenyl)-4-methoxy-6-oxopyridazine-3-carboxylate
CID 7386837
1-(4-fluorophenyl)-4-methoxy-N-(3-methylphenyl)-6-oxopyridazine-3-carboxamide
CID 8557146
4-hydroxy-N-[2-(4-methoxyphenoxy)ethyl]-1-(3-methylphenyl)-6-oxopyridazine-3-carboxamide
CID 108785145
4-methoxy-6-oxo-1-phenyl-N-propylpyridazine-3-carboxamide
CID 8553881
4-hydroxy-N-(2-methoxy-5-nitrophenyl)-1-(3-methylphenyl)-6-oxopyridazine-3-carboxamide
CID 108785165
4-methoxy-1-(2-methylphenyl)-6-oxopyridazine-3-carbonyl chloride
CID 142773071
N-benzhydryl-4-methoxy-6-oxo-1-phenylpyridazine-3-carboxamide
CID 26842143
N-(3-acetylphenyl)-4-methoxy-1-(4-methylphenyl)-6-oxopyridazine-3-carboxamide
CID 8555936
N-(2-hydroxyphenyl)-4-methoxy-6-oxo-1-phenylpyridazine-3-carboxamide
CID 8553640
4-hydroxy-1-(3-methylphenyl)-6-oxo-N-(4-phenoxyphenyl)pyridazine-3-carboxamide
CID 108785020

Frequently Asked Questions

What is the IUPAC name of N,4-dimethoxy-N-methyl-1-(3-methylphenyl)-6-oxopyridazine-3-carboxamide?
The IUPAC name of N,4-dimethoxy-N-methyl-1-(3-methylphenyl)-6-oxopyridazine-3-carboxamide (CID 58072218) is N,4-dimethoxy-N-methyl-1-(3-methylphenyl)-6-oxopyridazine-3-carboxamide.
What is the SMILES notation for N,4-dimethoxy-N-methyl-1-(3-methylphenyl)-6-oxopyridazine-3-carboxamide?
The canonical SMILES for N,4-dimethoxy-N-methyl-1-(3-methylphenyl)-6-oxopyridazine-3-carboxamide is COc1cc(=O)n(-c2cccc(C)c2)nc1C(=O)N(C)OC.
What is the InChIKey of N,4-dimethoxy-N-methyl-1-(3-methylphenyl)-6-oxopyridazine-3-carboxamide?
The InChIKey is YZLAKMKCOJJABR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O4/c1-10-6-5-7-11(8-10)18-13(19)9-12(21-3)14(16-18)15(20)17(2)22-4/h5-9H,1-4H3.
What are the key properties of N,4-dimethoxy-N-methyl-1-(3-methylphenyl)-6-oxopyridazine-3-carboxamide?
N,4-dimethoxy-N-methyl-1-(3-methylphenyl)-6-oxopyridazine-3-carboxamide has a molecular weight of 303.32 g/mol, XLogP of 1.18, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N,4-dimethoxy-N-methyl-1-(3-methylphenyl)-6-oxopyridazine-3-carboxamide is sourced from PubChem (CID 58072218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).