1-benzyl-6-oxo-N-(2-pyridin-2-ylethyl)pyridazine-3-carboxamide

C19H18N4O2 — CID 35864486

IUPAC1-benzyl-6-oxo-N-(2-pyridin-2-ylethyl)pyridazine-3-carboxamide
SMILESO=C(NCCc1ccccn1)c1ccc(=O)n(Cc2ccccc2)n1
InChIInChI=1S/C19H18N4O2/c24-18-10-9-17(22-23(18)14-15-6-2-1-3-7-15)19(25)21-13-11-16-8-4-5-12-20-16/h1-10,12H,11,13-14H2,(H,21,25)
InChIKeyJAEBUVDBSJSMNL-UHFFFAOYSA-N
MW334.38 g/mol
LogP1.66
Rot. Bonds6

About 1-benzyl-6-oxo-N-(2-pyridin-2-ylethyl)pyridazine-3-carboxamide

1-benzyl-6-oxo-N-(2-pyridin-2-ylethyl)pyridazine-3-carboxamide (PubChem CID 35864486) has the molecular formula C19H18N4O2 and a molecular weight of 334.38 g/mol. Its IUPAC name is 1-benzyl-6-oxo-N-(2-pyridin-2-ylethyl)pyridazine-3-carboxamide.

Molecular Properties

Compound Name1-benzyl-6-oxo-N-(2-pyridin-2-ylethyl)pyridazine-3-carboxamide
PubChem CID35864486
Molecular FormulaC19H18N4O2
Molecular Weight334.38 g/mol
Exact Mass334.14
IUPAC Name1-benzyl-6-oxo-N-(2-pyridin-2-ylethyl)pyridazine-3-carboxamide
SMILESO=C(NCCc1ccccn1)c1ccc(=O)n(Cc2ccccc2)n1
InChIInChI=1S/C19H18N4O2/c24-18-10-9-17(22-23(18)14-15-6-2-1-3-7-15)19(25)21-13-11-16-8-4-5-12-20-16/h1-10,12H,11,13-14H2,(H,21,25)
InChIKeyJAEBUVDBSJSMNL-UHFFFAOYSA-N
XLogP1.66
TPSA76.88 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.38
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-benzyl-6-oxo-N-[2-(6-oxo-3-phenylpyridazin-1-yl)ethyl]pyridazine-3-carboxamide
CID 121033347
1-benzyl-N-(2-methylpropyl)-6-oxopyridazine-3-carboxamide
CID 42161849
1-benzyl-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-6-oxopyridazine-3-carboxamide
CID 78804750
N-(2-amino-2-methylpropyl)-1-benzyl-6-oxopyridazine-3-carboxamide;hydrochloride
CID 119630257
1-benzyl-N-(3-cyclopentylpropyl)-6-oxopyridazine-3-carboxamide
CID 38857490
1-benzyl-N-[2-[(4-methylphenyl)methylsulfanyl]ethyl]-6-oxopyridazine-3-carboxamide
CID 32964770
1-benzyl-N-[(2-methylphenyl)methyl]-6-oxopyridazine-3-carboxamide
CID 39730942
1-benzyl-6-oxo-N-[2-[[4-(propanoylamino)benzoyl]amino]ethyl]pyridazine-3-carboxamide
CID 121067031
1-ethyl-6-oxo-N-(3-phenylpropyl)pyridazine-3-carboxamide
CID 121066866
1-[(4-fluorophenyl)methyl]-6-oxo-N-pyridin-2-ylpyridazine-3-carboxamide
CID 30859072
1-benzyl-N-[2-(2-nitroanilino)ethyl]-6-oxopyridazine-3-carboxamide
CID 9278557
1-benzyl-N-(2-iodophenyl)-6-oxopyridazine-3-carboxamide
CID 42993626

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-6-oxo-N-(2-pyridin-2-ylethyl)pyridazine-3-carboxamide?
The IUPAC name of 1-benzyl-6-oxo-N-(2-pyridin-2-ylethyl)pyridazine-3-carboxamide (CID 35864486) is 1-benzyl-6-oxo-N-(2-pyridin-2-ylethyl)pyridazine-3-carboxamide.
What is the SMILES notation for 1-benzyl-6-oxo-N-(2-pyridin-2-ylethyl)pyridazine-3-carboxamide?
The canonical SMILES for 1-benzyl-6-oxo-N-(2-pyridin-2-ylethyl)pyridazine-3-carboxamide is O=C(NCCc1ccccn1)c1ccc(=O)n(Cc2ccccc2)n1.
What is the InChIKey of 1-benzyl-6-oxo-N-(2-pyridin-2-ylethyl)pyridazine-3-carboxamide?
The InChIKey is JAEBUVDBSJSMNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N4O2/c24-18-10-9-17(22-23(18)14-15-6-2-1-3-7-15)19(25)21-13-11-16-8-4-5-12-20-16/h1-10,12H,11,13-14H2,(H,21,25).
What are the key properties of 1-benzyl-6-oxo-N-(2-pyridin-2-ylethyl)pyridazine-3-carboxamide?
1-benzyl-6-oxo-N-(2-pyridin-2-ylethyl)pyridazine-3-carboxamide has a molecular weight of 334.38 g/mol, XLogP of 1.66, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-6-oxo-N-(2-pyridin-2-ylethyl)pyridazine-3-carboxamide is sourced from PubChem (CID 35864486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).