2-(3-methylphenyl)-N-[6-(3-methylpiperidin-1-yl)pyridazin-3-yl]acetamide

C19H24N4O — CID 113045060

IUPAC2-(3-methylphenyl)-N-[6-(3-methylpiperidin-1-yl)pyridazin-3-yl]acetamide
SMILESCc1cccc(CC(=O)Nc2ccc(N3CCCC(C)C3)nn2)c1
InChIInChI=1S/C19H24N4O/c1-14-5-3-7-16(11-14)12-19(24)20-17-8-9-18(22-21-17)23-10-4-6-15(2)13-23/h3,5,7-9,11,15H,4,6,10,12-13H2,1-2H3,(H,20,21,24)
InChIKeyLGXXWFXSQXKJRS-UHFFFAOYSA-N
MW324.43 g/mol
LogP3.20
Rot. Bonds4

About 2-(3-methylphenyl)-N-[6-(3-methylpiperidin-1-yl)pyridazin-3-yl]acetamide

2-(3-methylphenyl)-N-[6-(3-methylpiperidin-1-yl)pyridazin-3-yl]acetamide (PubChem CID 113045060) has the molecular formula C19H24N4O and a molecular weight of 324.43 g/mol. Its IUPAC name is 2-(3-methylphenyl)-N-[6-(3-methylpiperidin-1-yl)pyridazin-3-yl]acetamide.

Molecular Properties

Compound Name2-(3-methylphenyl)-N-[6-(3-methylpiperidin-1-yl)pyridazin-3-yl]acetamide
PubChem CID113045060
Molecular FormulaC19H24N4O
Molecular Weight324.43 g/mol
Exact Mass324.20
IUPAC Name2-(3-methylphenyl)-N-[6-(3-methylpiperidin-1-yl)pyridazin-3-yl]acetamide
SMILESCc1cccc(CC(=O)Nc2ccc(N3CCCC(C)C3)nn2)c1
InChIInChI=1S/C19H24N4O/c1-14-5-3-7-16(11-14)12-19(24)20-17-8-9-18(22-21-17)23-10-4-6-15(2)13-23/h3,5,7-9,11,15H,4,6,10,12-13H2,1-2H3,(H,20,21,24)
InChIKeyLGXXWFXSQXKJRS-UHFFFAOYSA-N
XLogP3.20
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.43
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[6-[[2-(3-methylphenyl)acetyl]amino]pyridazin-3-yl]piperidine-3-carboxylic acid
CID 122660230
2-(4-methoxyphenyl)-N-[6-(3-methylpiperidin-1-yl)pyridazin-3-yl]acetamide
CID 113045038
N-[6-[4-(cyanomethyl)piperidin-1-yl]pyridazin-3-yl]-2-(3-methylphenyl)acetamide
CID 122660232
N-[6-(3-methylpiperidin-1-yl)pyridazin-3-yl]cyclopropanecarboxamide
CID 113045004
2-(3-bromophenyl)-N-[6-(4-methylpiperidin-1-yl)pyridazin-3-yl]acetamide
CID 113039248
3-chloro-N-[6-(3-methylpiperidin-1-yl)pyridazin-3-yl]benzamide
CID 113045045
N-[6-(3-methylpiperidin-1-yl)pyridazin-3-yl]-3-phenoxypropanamide
CID 113045043
2-(3-fluorophenyl)-N-(6-piperidin-1-ylpyridazin-3-yl)acetamide
CID 113038996
N-[6-[4-(3-methylphenyl)piperazin-1-yl]pyridazin-3-yl]propanamide
CID 113043638
N-benzyl-6-(3-methylpiperidin-1-yl)pyridazine-3-carboxamide
CID 109117891
2-(3-bromophenyl)-N-[6-(4-methylpiperazin-1-yl)pyridazin-3-yl]acetamide
CID 113040272
N-[5-[1-[6-[3-(3-methylphenyl)-2-oxopropyl]pyridazin-3-yl]piperidin-3-yl]-1,3,4-thiadiazol-2-yl]acetamide
CID 160809349

Frequently Asked Questions

What is the IUPAC name of 2-(3-methylphenyl)-N-[6-(3-methylpiperidin-1-yl)pyridazin-3-yl]acetamide?
The IUPAC name of 2-(3-methylphenyl)-N-[6-(3-methylpiperidin-1-yl)pyridazin-3-yl]acetamide (CID 113045060) is 2-(3-methylphenyl)-N-[6-(3-methylpiperidin-1-yl)pyridazin-3-yl]acetamide.
What is the SMILES notation for 2-(3-methylphenyl)-N-[6-(3-methylpiperidin-1-yl)pyridazin-3-yl]acetamide?
The canonical SMILES for 2-(3-methylphenyl)-N-[6-(3-methylpiperidin-1-yl)pyridazin-3-yl]acetamide is Cc1cccc(CC(=O)Nc2ccc(N3CCCC(C)C3)nn2)c1.
What is the InChIKey of 2-(3-methylphenyl)-N-[6-(3-methylpiperidin-1-yl)pyridazin-3-yl]acetamide?
The InChIKey is LGXXWFXSQXKJRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O/c1-14-5-3-7-16(11-14)12-19(24)20-17-8-9-18(22-21-17)23-10-4-6-15(2)13-23/h3,5,7-9,11,15H,4,6,10,12-13H2,1-2H3,(H,20,21,24).
What are the key properties of 2-(3-methylphenyl)-N-[6-(3-methylpiperidin-1-yl)pyridazin-3-yl]acetamide?
2-(3-methylphenyl)-N-[6-(3-methylpiperidin-1-yl)pyridazin-3-yl]acetamide has a molecular weight of 324.43 g/mol, XLogP of 3.20, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methylphenyl)-N-[6-(3-methylpiperidin-1-yl)pyridazin-3-yl]acetamide is sourced from PubChem (CID 113045060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).