2-(4-methoxyphenyl)-N-[6-[(2-methylphenyl)methylamino]pyridazin-3-yl]acetamide

C21H22N4O2 — CID 113040895

IUPAC2-(4-methoxyphenyl)-N-[6-[(2-methylphenyl)methylamino]pyridazin-3-yl]acetamide
SMILESCOc1ccc(CC(=O)Nc2ccc(NCc3ccccc3C)nn2)cc1
InChIInChI=1S/C21H22N4O2/c1-15-5-3-4-6-17(15)14-22-19-11-12-20(25-24-19)23-21(26)13-16-7-9-18(27-2)10-8-16/h3-12H,13-14H2,1-2H3,(H,22,24)(H,23,25,26)
InChIKeyWIUQAXHNGYEWKW-UHFFFAOYSA-N
MW362.43 g/mol
LogP3.59
Rot. Bonds7

About 2-(4-methoxyphenyl)-N-[6-[(2-methylphenyl)methylamino]pyridazin-3-yl]acetamide

2-(4-methoxyphenyl)-N-[6-[(2-methylphenyl)methylamino]pyridazin-3-yl]acetamide (PubChem CID 113040895) has the molecular formula C21H22N4O2 and a molecular weight of 362.43 g/mol. Its IUPAC name is 2-(4-methoxyphenyl)-N-[6-[(2-methylphenyl)methylamino]pyridazin-3-yl]acetamide.

Molecular Properties

Compound Name2-(4-methoxyphenyl)-N-[6-[(2-methylphenyl)methylamino]pyridazin-3-yl]acetamide
PubChem CID113040895
Molecular FormulaC21H22N4O2
Molecular Weight362.43 g/mol
Exact Mass362.17
IUPAC Name2-(4-methoxyphenyl)-N-[6-[(2-methylphenyl)methylamino]pyridazin-3-yl]acetamide
SMILESCOc1ccc(CC(=O)Nc2ccc(NCc3ccccc3C)nn2)cc1
InChIInChI=1S/C21H22N4O2/c1-15-5-3-4-6-17(15)14-22-19-11-12-20(25-24-19)23-21(26)13-16-7-9-18(27-2)10-8-16/h3-12H,13-14H2,1-2H3,(H,22,24)(H,23,25,26)
InChIKeyWIUQAXHNGYEWKW-UHFFFAOYSA-N
XLogP3.59
TPSA76.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.43
LogP ≤ 53.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(2-fluorophenyl)-N-[6-[(4-methoxyphenyl)methylamino]pyridazin-3-yl]acetamide
CID 113041787
N-(4-methoxyphenyl)-6-[(2-methylphenyl)methylamino]pyridazine-3-carboxamide
CID 109118070
N-[6-(furan-2-ylmethylamino)pyridazin-3-yl]-2-(4-methoxyphenyl)acetamide
CID 113040667
2-(4-methoxyphenyl)-N-[6-(propylamino)pyridazin-3-yl]acetamide
CID 113037821
3-methoxy-N-[6-[(2-methylphenyl)methylamino]pyridazin-3-yl]benzamide
CID 113040884
N-[5-[(4-methoxyphenyl)methylamino]-2-pyridinyl]-2-(2-methylphenyl)acetamide
CID 113027443
N-[6-(2-ethylanilino)pyridazin-3-yl]-2-(4-methoxyphenyl)acetamide
CID 113046657
N-[6-[2-(2-methoxyphenyl)ethylamino]pyridazin-3-yl]-2-(2-methylphenyl)acetamide
CID 113042675
N-[6-[(4-methoxyphenyl)methylamino]pyridazin-3-yl]benzamide
CID 113041752
2-(4-methoxyphenyl)-N-[6-(3-methoxypropylamino)pyridazin-3-yl]acetamide
CID 113039555
N-(4-methoxyphenyl)-2-(2-methylphenyl)acetamide
CID 6467093
2-(4-methoxyphenyl)-N-[6-[(2-methoxyphenyl)methylamino]-3-pyridinyl]acetamide
CID 113012370

Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenyl)-N-[6-[(2-methylphenyl)methylamino]pyridazin-3-yl]acetamide?
The IUPAC name of 2-(4-methoxyphenyl)-N-[6-[(2-methylphenyl)methylamino]pyridazin-3-yl]acetamide (CID 113040895) is 2-(4-methoxyphenyl)-N-[6-[(2-methylphenyl)methylamino]pyridazin-3-yl]acetamide.
What is the SMILES notation for 2-(4-methoxyphenyl)-N-[6-[(2-methylphenyl)methylamino]pyridazin-3-yl]acetamide?
The canonical SMILES for 2-(4-methoxyphenyl)-N-[6-[(2-methylphenyl)methylamino]pyridazin-3-yl]acetamide is COc1ccc(CC(=O)Nc2ccc(NCc3ccccc3C)nn2)cc1.
What is the InChIKey of 2-(4-methoxyphenyl)-N-[6-[(2-methylphenyl)methylamino]pyridazin-3-yl]acetamide?
The InChIKey is WIUQAXHNGYEWKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H22N4O2/c1-15-5-3-4-6-17(15)14-22-19-11-12-20(25-24-19)23-21(26)13-16-7-9-18(27-2)10-8-16/h3-12H,13-14H2,1-2H3,(H,22,24)(H,23,25,26).
What are the key properties of 2-(4-methoxyphenyl)-N-[6-[(2-methylphenyl)methylamino]pyridazin-3-yl]acetamide?
2-(4-methoxyphenyl)-N-[6-[(2-methylphenyl)methylamino]pyridazin-3-yl]acetamide has a molecular weight of 362.43 g/mol, XLogP of 3.59, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenyl)-N-[6-[(2-methylphenyl)methylamino]pyridazin-3-yl]acetamide is sourced from PubChem (CID 113040895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).