N-(4-ethylphenyl)-6-methyl-4-oxo-1-phenylpyridazine-3-carboxamide

C20H19N3O2 — CID 9078101

IUPACN-(4-ethylphenyl)-6-methyl-4-oxo-1-phenylpyridazine-3-carboxamide
SMILESCCc1ccc(NC(=O)c2nn(-c3ccccc3)c(C)cc2=O)cc1
InChIInChI=1S/C20H19N3O2/c1-3-15-9-11-16(12-10-15)21-20(25)19-18(24)13-14(2)23(22-19)17-7-5-4-6-8-17/h4-13H,3H2,1-2H3,(H,21,25)
InChIKeyGDXSCPYTPYMWTO-UHFFFAOYSA-N
MW333.39 g/mol
LogP3.36
Rot. Bonds4

About N-(4-ethylphenyl)-6-methyl-4-oxo-1-phenylpyridazine-3-carboxamide

N-(4-ethylphenyl)-6-methyl-4-oxo-1-phenylpyridazine-3-carboxamide (PubChem CID 9078101) has the molecular formula C20H19N3O2 and a molecular weight of 333.39 g/mol. Its IUPAC name is N-(4-ethylphenyl)-6-methyl-4-oxo-1-phenylpyridazine-3-carboxamide.

Molecular Properties

Compound NameN-(4-ethylphenyl)-6-methyl-4-oxo-1-phenylpyridazine-3-carboxamide
PubChem CID9078101
Molecular FormulaC20H19N3O2
Molecular Weight333.39 g/mol
Exact Mass333.15
IUPAC NameN-(4-ethylphenyl)-6-methyl-4-oxo-1-phenylpyridazine-3-carboxamide
SMILESCCc1ccc(NC(=O)c2nn(-c3ccccc3)c(C)cc2=O)cc1
InChIInChI=1S/C20H19N3O2/c1-3-15-9-11-16(12-10-15)21-20(25)19-18(24)13-14(2)23(22-19)17-7-5-4-6-8-17/h4-13H,3H2,1-2H3,(H,21,25)
InChIKeyGDXSCPYTPYMWTO-UHFFFAOYSA-N
XLogP3.36
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.39
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(4-ethylphenyl)-6-methyl-4-oxo-1-phenylpyridazine-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-(4-chlorophenyl)-N-(4-ethylphenyl)-6-methyl-4-oxopyridazine-3-carboxamide
CID 9077968
N-[4-(cyanomethyl)phenyl]-6-methyl-4-oxo-1-phenylpyridazine-3-carboxamide
CID 27163514
6-methyl-N-(4-methylsulfanylphenyl)-4-oxo-1-phenylpyridazine-3-carboxamide
CID 8810913
N-(2-ethylphenyl)-6-methyl-4-oxo-1-phenylpyridazine-3-carboxamide
CID 8565302
6-methyl-4-oxo-1-phenyl-N-[4-(1,3-thiazol-2-yl)phenyl]pyridazine-3-carboxamide
CID 55427141
methyl 2-chloro-5-[(6-methyl-4-oxo-1-phenylpyridazine-3-carbonyl)amino]benzoate
CID 34161619
6-methyl-4-oxo-1-phenyl-N-(1-propylindol-5-yl)pyridazine-3-carboxamide
CID 60609063
N-(3-methoxyphenyl)-6-methyl-4-oxo-1-phenylpyridazine-3-carboxamide
CID 17399746
N-[2-(2-ethylanilino)-2-oxoethyl]-6-methyl-4-oxo-1-phenylpyridazine-3-carboxamide
CID 9090833
N-[2-(ethylamino)-2-oxoethyl]-6-methyl-4-oxo-1-phenylpyridazine-3-carboxamide
CID 86909633
(4-acetamidophenyl) 6-methyl-4-oxo-1-phenylpyridazine-3-carboxylate
CID 56809288
(2-anilino-2-oxoethyl) 6-methyl-4-oxo-1-phenylpyridazine-3-carboxylate
CID 33124998

Frequently Asked Questions

What is the IUPAC name of N-(4-ethylphenyl)-6-methyl-4-oxo-1-phenylpyridazine-3-carboxamide?
The IUPAC name of N-(4-ethylphenyl)-6-methyl-4-oxo-1-phenylpyridazine-3-carboxamide (CID 9078101) is N-(4-ethylphenyl)-6-methyl-4-oxo-1-phenylpyridazine-3-carboxamide.
What is the SMILES notation for N-(4-ethylphenyl)-6-methyl-4-oxo-1-phenylpyridazine-3-carboxamide?
The canonical SMILES for N-(4-ethylphenyl)-6-methyl-4-oxo-1-phenylpyridazine-3-carboxamide is CCc1ccc(NC(=O)c2nn(-c3ccccc3)c(C)cc2=O)cc1.
What is the InChIKey of N-(4-ethylphenyl)-6-methyl-4-oxo-1-phenylpyridazine-3-carboxamide?
The InChIKey is GDXSCPYTPYMWTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3O2/c1-3-15-9-11-16(12-10-15)21-20(25)19-18(24)13-14(2)23(22-19)17-7-5-4-6-8-17/h4-13H,3H2,1-2H3,(H,21,25).
What are the key properties of N-(4-ethylphenyl)-6-methyl-4-oxo-1-phenylpyridazine-3-carboxamide?
N-(4-ethylphenyl)-6-methyl-4-oxo-1-phenylpyridazine-3-carboxamide has a molecular weight of 333.39 g/mol, XLogP of 3.36, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethylphenyl)-6-methyl-4-oxo-1-phenylpyridazine-3-carboxamide is sourced from PubChem (CID 9078101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).