N-(2,3-dimethylphenyl)-6-phenylpyridazine-3-carboxamide

C19H17N3O — CID 113200610

IUPACN-(2,3-dimethylphenyl)-6-phenylpyridazine-3-carboxamide
SMILESCc1cccc(NC(=O)c2ccc(-c3ccccc3)nn2)c1C
InChIInChI=1S/C19H17N3O/c1-13-7-6-10-16(14(13)2)20-19(23)18-12-11-17(21-22-18)15-8-4-3-5-9-15/h3-12H,1-2H3,(H,20,23)
InChIKeyZGRJNONWLVSPJF-UHFFFAOYSA-N
MW303.37 g/mol
LogP4.01
Rot. Bonds3

About N-(2,3-dimethylphenyl)-6-phenylpyridazine-3-carboxamide

N-(2,3-dimethylphenyl)-6-phenylpyridazine-3-carboxamide (PubChem CID 113200610) has the molecular formula C19H17N3O and a molecular weight of 303.37 g/mol. Its IUPAC name is N-(2,3-dimethylphenyl)-6-phenylpyridazine-3-carboxamide.

Molecular Properties

Compound NameN-(2,3-dimethylphenyl)-6-phenylpyridazine-3-carboxamide
PubChem CID113200610
Molecular FormulaC19H17N3O
Molecular Weight303.37 g/mol
Exact Mass303.14
IUPAC NameN-(2,3-dimethylphenyl)-6-phenylpyridazine-3-carboxamide
SMILESCc1cccc(NC(=O)c2ccc(-c3ccccc3)nn2)c1C
InChIInChI=1S/C19H17N3O/c1-13-7-6-10-16(14(13)2)20-19(23)18-12-11-17(21-22-18)15-8-4-3-5-9-15/h3-12H,1-2H3,(H,20,23)
InChIKeyZGRJNONWLVSPJF-UHFFFAOYSA-N
XLogP4.01
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.37
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,3-dichlorophenyl)-6-phenylpyridazine-3-carboxamide
CID 113200687
N-(2-fluorophenyl)-6-phenylpyridazine-3-carboxamide
CID 113200620
N-(2,3-dimethylphenyl)-6-(ethylamino)pyridazine-3-carboxamide
CID 62166086
methyl 6-[(2-methyl-3-phenylphenyl)carbamoyl]pyridazine-3-carboxylate
CID 129240369
N-(2,4-dichlorophenyl)-6-phenylpyridazine-3-carboxamide
CID 113200683
N-(2,3-dimethylphenyl)-6-[(4-fluorophenyl)methylamino]pyridazine-3-carboxamide
CID 109119458
N-tert-butyl-6-phenylpyridazine-3-carboxamide
CID 113200586
N-(4-ethylphenyl)-6-phenylpyridazine-3-carboxamide
CID 113200612
6-(benzylamino)-N-(2,3-dimethylphenyl)-2-methylpyrimidine-4-carboxamide
CID 109368287
N-(2-cyanophenyl)-6-(2,3-dimethylanilino)pyridazine-3-carboxamide
CID 109127858
1-benzyl-N-(2,3-dimethylphenyl)triazole-4-carboxamide
CID 18146607
N-(2,3-dimethylphenyl)-5-methylpyrazine-2-carboxamide
CID 16613943

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dimethylphenyl)-6-phenylpyridazine-3-carboxamide?
The IUPAC name of N-(2,3-dimethylphenyl)-6-phenylpyridazine-3-carboxamide (CID 113200610) is N-(2,3-dimethylphenyl)-6-phenylpyridazine-3-carboxamide.
What is the SMILES notation for N-(2,3-dimethylphenyl)-6-phenylpyridazine-3-carboxamide?
The canonical SMILES for N-(2,3-dimethylphenyl)-6-phenylpyridazine-3-carboxamide is Cc1cccc(NC(=O)c2ccc(-c3ccccc3)nn2)c1C.
What is the InChIKey of N-(2,3-dimethylphenyl)-6-phenylpyridazine-3-carboxamide?
The InChIKey is ZGRJNONWLVSPJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N3O/c1-13-7-6-10-16(14(13)2)20-19(23)18-12-11-17(21-22-18)15-8-4-3-5-9-15/h3-12H,1-2H3,(H,20,23).
What are the key properties of N-(2,3-dimethylphenyl)-6-phenylpyridazine-3-carboxamide?
N-(2,3-dimethylphenyl)-6-phenylpyridazine-3-carboxamide has a molecular weight of 303.37 g/mol, XLogP of 4.01, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dimethylphenyl)-6-phenylpyridazine-3-carboxamide is sourced from PubChem (CID 113200610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).