2-phenyl-N-[6-(4-pyridin-2-ylpiperazin-1-yl)pyridazin-3-yl]acetamide

C21H22N6O — CID 113043868

IUPAC2-phenyl-N-[6-(4-pyridin-2-ylpiperazin-1-yl)pyridazin-3-yl]acetamide
SMILESO=C(Cc1ccccc1)Nc1ccc(N2CCN(c3ccccn3)CC2)nn1
InChIInChI=1S/C21H22N6O/c28-21(16-17-6-2-1-3-7-17)23-18-9-10-20(25-24-18)27-14-12-26(13-15-27)19-8-4-5-11-22-19/h1-11H,12-16H2,(H,23,24,28)
InChIKeyCYEHMMXVMLSCGV-UHFFFAOYSA-N
MW374.45 g/mol
LogP2.38
Rot. Bonds5

About 2-phenyl-N-[6-(4-pyridin-2-ylpiperazin-1-yl)pyridazin-3-yl]acetamide

2-phenyl-N-[6-(4-pyridin-2-ylpiperazin-1-yl)pyridazin-3-yl]acetamide (PubChem CID 113043868) has the molecular formula C21H22N6O and a molecular weight of 374.45 g/mol. Its IUPAC name is 2-phenyl-N-[6-(4-pyridin-2-ylpiperazin-1-yl)pyridazin-3-yl]acetamide.

Molecular Properties

Compound Name2-phenyl-N-[6-(4-pyridin-2-ylpiperazin-1-yl)pyridazin-3-yl]acetamide
PubChem CID113043868
Molecular FormulaC21H22N6O
Molecular Weight374.45 g/mol
Exact Mass374.19
IUPAC Name2-phenyl-N-[6-(4-pyridin-2-ylpiperazin-1-yl)pyridazin-3-yl]acetamide
SMILESO=C(Cc1ccccc1)Nc1ccc(N2CCN(c3ccccn3)CC2)nn1
InChIInChI=1S/C21H22N6O/c28-21(16-17-6-2-1-3-7-17)23-18-9-10-20(25-24-18)27-14-12-26(13-15-27)19-8-4-5-11-22-19/h1-11H,12-16H2,(H,23,24,28)
InChIKeyCYEHMMXVMLSCGV-UHFFFAOYSA-N
XLogP2.38
TPSA74.25 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.45
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(6-morpholin-4-ylpyridazin-3-yl)-2-phenylacetamide
CID 113039672
3-phenyl-N-[6-(4-pyrimidin-2-ylpiperazin-1-yl)pyridazin-3-yl]propanamide
CID 113043924
4-chloro-N-[6-(4-pyridin-2-ylpiperazin-1-yl)pyridazin-3-yl]benzamide
CID 113043874
2-phenyl-1-[4-[6-(pyridin-2-ylamino)pyridazin-3-yl]piperazin-1-yl]ethanone
CID 56699859
N-[6-(4-pyridin-2-ylpiperazin-1-yl)pyridazin-3-yl]benzenesulfonamide
CID 113043896
N-[6-(4-acetylpiperazin-1-yl)pyridazin-3-yl]-2-(2-methylphenyl)acetamide
CID 113040589
2-(3-bromophenyl)-N-[6-(4-methylpiperazin-1-yl)pyridazin-3-yl]acetamide
CID 113040272
3-phenyl-1-[4-[6-(pyridin-2-ylamino)pyridazin-3-yl]piperazin-1-yl]propan-1-one
CID 56699361
2-phenyl-N-(1-pyridin-2-ylpyrazol-3-yl)acetamide
CID 135315915
3-(dimethylsulfamoylamino)-6-(4-pyridin-2-ylpiperazin-1-yl)pyridazine
CID 113043895
ethyl 4-[6-[[2-(4-methylphenyl)acetyl]amino]pyridazin-3-yl]piperazine-1-carboxylate
CID 113043606
2-(3-fluorophenyl)-N-(6-piperidin-1-ylpyridazin-3-yl)acetamide
CID 113038996

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-N-[6-(4-pyridin-2-ylpiperazin-1-yl)pyridazin-3-yl]acetamide?
The IUPAC name of 2-phenyl-N-[6-(4-pyridin-2-ylpiperazin-1-yl)pyridazin-3-yl]acetamide (CID 113043868) is 2-phenyl-N-[6-(4-pyridin-2-ylpiperazin-1-yl)pyridazin-3-yl]acetamide.
What is the SMILES notation for 2-phenyl-N-[6-(4-pyridin-2-ylpiperazin-1-yl)pyridazin-3-yl]acetamide?
The canonical SMILES for 2-phenyl-N-[6-(4-pyridin-2-ylpiperazin-1-yl)pyridazin-3-yl]acetamide is O=C(Cc1ccccc1)Nc1ccc(N2CCN(c3ccccn3)CC2)nn1.
What is the InChIKey of 2-phenyl-N-[6-(4-pyridin-2-ylpiperazin-1-yl)pyridazin-3-yl]acetamide?
The InChIKey is CYEHMMXVMLSCGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H22N6O/c28-21(16-17-6-2-1-3-7-17)23-18-9-10-20(25-24-18)27-14-12-26(13-15-27)19-8-4-5-11-22-19/h1-11H,12-16H2,(H,23,24,28).
What are the key properties of 2-phenyl-N-[6-(4-pyridin-2-ylpiperazin-1-yl)pyridazin-3-yl]acetamide?
2-phenyl-N-[6-(4-pyridin-2-ylpiperazin-1-yl)pyridazin-3-yl]acetamide has a molecular weight of 374.45 g/mol, XLogP of 2.38, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-N-[6-(4-pyridin-2-ylpiperazin-1-yl)pyridazin-3-yl]acetamide is sourced from PubChem (CID 113043868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).