N-(6-phenylpyridazin-3-yl)-2-(4-pyridazin-4-ylphenyl)acetamide

C22H17N5O — CID 58447710

IUPACN-(6-phenylpyridazin-3-yl)-2-(4-pyridazin-4-ylphenyl)acetamide
SMILESO=C(Cc1ccc(-c2ccnnc2)cc1)Nc1ccc(-c2ccccc2)nn1
InChIInChI=1S/C22H17N5O/c28-22(14-16-6-8-17(9-7-16)19-12-13-23-24-15-19)25-21-11-10-20(26-27-21)18-4-2-1-3-5-18/h1-13,15H,14H2,(H,25,27,28)
InChIKeyPBFDXGBPUVDWDW-UHFFFAOYSA-N
MW367.41 g/mol
LogP3.78
Rot. Bonds5

About N-(6-phenylpyridazin-3-yl)-2-(4-pyridazin-4-ylphenyl)acetamide

N-(6-phenylpyridazin-3-yl)-2-(4-pyridazin-4-ylphenyl)acetamide (PubChem CID 58447710) has the molecular formula C22H17N5O and a molecular weight of 367.41 g/mol. Its IUPAC name is N-(6-phenylpyridazin-3-yl)-2-(4-pyridazin-4-ylphenyl)acetamide.

Molecular Properties

Compound NameN-(6-phenylpyridazin-3-yl)-2-(4-pyridazin-4-ylphenyl)acetamide
PubChem CID58447710
Molecular FormulaC22H17N5O
Molecular Weight367.41 g/mol
Exact Mass367.14
IUPAC NameN-(6-phenylpyridazin-3-yl)-2-(4-pyridazin-4-ylphenyl)acetamide
SMILESO=C(Cc1ccc(-c2ccnnc2)cc1)Nc1ccc(-c2ccccc2)nn1
InChIInChI=1S/C22H17N5O/c28-22(14-16-6-8-17(9-7-16)19-12-13-23-24-15-19)25-21-11-10-20(26-27-21)18-4-2-1-3-5-18/h1-13,15H,14H2,(H,25,27,28)
InChIKeyPBFDXGBPUVDWDW-UHFFFAOYSA-N
XLogP3.78
TPSA80.66 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.41
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(6-phenylpyridazin-3-yl)-2-(4-pyridazin-4-ylphenyl)acetamide?
The IUPAC name of N-(6-phenylpyridazin-3-yl)-2-(4-pyridazin-4-ylphenyl)acetamide (CID 58447710) is N-(6-phenylpyridazin-3-yl)-2-(4-pyridazin-4-ylphenyl)acetamide.
What is the SMILES notation for N-(6-phenylpyridazin-3-yl)-2-(4-pyridazin-4-ylphenyl)acetamide?
The canonical SMILES for N-(6-phenylpyridazin-3-yl)-2-(4-pyridazin-4-ylphenyl)acetamide is O=C(Cc1ccc(-c2ccnnc2)cc1)Nc1ccc(-c2ccccc2)nn1.
What is the InChIKey of N-(6-phenylpyridazin-3-yl)-2-(4-pyridazin-4-ylphenyl)acetamide?
The InChIKey is PBFDXGBPUVDWDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H17N5O/c28-22(14-16-6-8-17(9-7-16)19-12-13-23-24-15-19)25-21-11-10-20(26-27-21)18-4-2-1-3-5-18/h1-13,15H,14H2,(H,25,27,28).
What are the key properties of N-(6-phenylpyridazin-3-yl)-2-(4-pyridazin-4-ylphenyl)acetamide?
N-(6-phenylpyridazin-3-yl)-2-(4-pyridazin-4-ylphenyl)acetamide has a molecular weight of 367.41 g/mol, XLogP of 3.78, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-phenylpyridazin-3-yl)-2-(4-pyridazin-4-ylphenyl)acetamide is sourced from PubChem (CID 58447710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).