N-(4-acetylphenyl)-6-oxo-1-phenyl-4,5-dihydropyridazine-3-carboxamide

C19H17N3O3 — CID 5124890

IUPACN-(4-acetylphenyl)-6-oxo-1-phenyl-4,5-dihydropyridazine-3-carboxamide
SMILESCC(=O)c1ccc(NC(=O)C2=NN(c3ccccc3)C(=O)CC2)cc1
InChIInChI=1S/C19H17N3O3/c1-13(23)14-7-9-15(10-8-14)20-19(25)17-11-12-18(24)22(21-17)16-5-3-2-4-6-16/h2-10H,11-12H2,1H3,(H,20,25)
InChIKeySXBRUDPTUYYLFM-UHFFFAOYSA-N
MW335.36 g/mol
LogP3.01
Rot. Bonds4

About N-(4-acetylphenyl)-6-oxo-1-phenyl-4,5-dihydropyridazine-3-carboxamide

N-(4-acetylphenyl)-6-oxo-1-phenyl-4,5-dihydropyridazine-3-carboxamide (PubChem CID 5124890) has the molecular formula C19H17N3O3 and a molecular weight of 335.36 g/mol. Its IUPAC name is N-(4-acetylphenyl)-6-oxo-1-phenyl-4,5-dihydropyridazine-3-carboxamide.

Molecular Properties

Compound NameN-(4-acetylphenyl)-6-oxo-1-phenyl-4,5-dihydropyridazine-3-carboxamide
PubChem CID5124890
Molecular FormulaC19H17N3O3
Molecular Weight335.36 g/mol
Exact Mass335.13
IUPAC NameN-(4-acetylphenyl)-6-oxo-1-phenyl-4,5-dihydropyridazine-3-carboxamide
SMILESCC(=O)c1ccc(NC(=O)C2=NN(c3ccccc3)C(=O)CC2)cc1
InChIInChI=1S/C19H17N3O3/c1-13(23)14-7-9-15(10-8-14)20-19(25)17-11-12-18(24)22(21-17)16-5-3-2-4-6-16/h2-10H,11-12H2,1H3,(H,20,25)
InChIKeySXBRUDPTUYYLFM-UHFFFAOYSA-N
XLogP3.01
TPSA78.84 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.36
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(4-acetylphenyl)-6-oxo-1-phenyl-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

N-(4-methoxyphenyl)-6-oxo-1-phenyl-4,5-dihydropyridazine-3-carboxamide
CID 945023
N-[4-(diethylsulfamoyl)phenyl]-6-oxo-1-phenyl-4,5-dihydropyridazine-3-carboxamide
CID 5135964
N,1-bis(4-methoxyphenyl)-6-oxo-4,5-dihydropyridazine-3-carboxamide
CID 15995625
6-oxo-1-phenyl-N-propan-2-yl-4,5-dihydropyridazine-3-carboxamide
CID 3469498
N-(2-cyanophenyl)-6-oxo-1-phenyl-4,5-dihydropyridazine-3-carboxamide
CID 7711443
N-[4-(1,3-benzoxazol-2-yl)phenyl]-6-oxo-1-phenyl-4,5-dihydropyridazine-3-carboxamide
CID 24599427
6-oxo-1-phenyl-N-(1,3-thiazol-2-yl)-4,5-dihydropyridazine-3-carboxamide
CID 7740879
1-(4-bromophenyl)-N-(4-fluorophenyl)-6-oxo-4,5-dihydropyridazine-3-carboxamide
CID 4679749
N-(3,4-dimethylphenyl)-1-(4-methylphenyl)-6-oxo-4,5-dihydropyridazine-3-carboxamide
CID 942686
N-[4-[(2-methoxyphenyl)carbamoyl]phenyl]-1-(3-methylphenyl)-6-oxo-4,5-dihydropyridazine-3-carboxamide
CID 30249845
N-(2,4-dichlorophenyl)-6-oxo-1-phenyl-4,5-dihydropyridazine-3-carboxamide
CID 4268456
N-(5-chloro-2-pyridinyl)-6-oxo-1-phenyl-4,5-dihydropyridazine-3-carboxamide
CID 7711410

Frequently Asked Questions

What is the IUPAC name of N-(4-acetylphenyl)-6-oxo-1-phenyl-4,5-dihydropyridazine-3-carboxamide?
The IUPAC name of N-(4-acetylphenyl)-6-oxo-1-phenyl-4,5-dihydropyridazine-3-carboxamide (CID 5124890) is N-(4-acetylphenyl)-6-oxo-1-phenyl-4,5-dihydropyridazine-3-carboxamide.
What is the SMILES notation for N-(4-acetylphenyl)-6-oxo-1-phenyl-4,5-dihydropyridazine-3-carboxamide?
The canonical SMILES for N-(4-acetylphenyl)-6-oxo-1-phenyl-4,5-dihydropyridazine-3-carboxamide is CC(=O)c1ccc(NC(=O)C2=NN(c3ccccc3)C(=O)CC2)cc1.
What is the InChIKey of N-(4-acetylphenyl)-6-oxo-1-phenyl-4,5-dihydropyridazine-3-carboxamide?
The InChIKey is SXBRUDPTUYYLFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N3O3/c1-13(23)14-7-9-15(10-8-14)20-19(25)17-11-12-18(24)22(21-17)16-5-3-2-4-6-16/h2-10H,11-12H2,1H3,(H,20,25).
What are the key properties of N-(4-acetylphenyl)-6-oxo-1-phenyl-4,5-dihydropyridazine-3-carboxamide?
N-(4-acetylphenyl)-6-oxo-1-phenyl-4,5-dihydropyridazine-3-carboxamide has a molecular weight of 335.36 g/mol, XLogP of 3.01, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetylphenyl)-6-oxo-1-phenyl-4,5-dihydropyridazine-3-carboxamide is sourced from PubChem (CID 5124890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).