N-[6-(2-hydroxyphenyl)pyridazin-3-yl]acetamide

C12H11N3O2 — CID 137045892

IUPACN-[6-(2-hydroxyphenyl)pyridazin-3-yl]acetamide
SMILESCC(=O)Nc1ccc(-c2ccccc2O)nn1
InChIInChI=1S/C12H11N3O2/c1-8(16)13-12-7-6-10(14-15-12)9-4-2-3-5-11(9)17/h2-7,17H,1H3,(H,13,15,16)
InChIKeyQIIPAFJJLGMKGH-UHFFFAOYSA-N
MW229.24 g/mol
LogP1.81
Rot. Bonds2

About N-[6-(2-hydroxyphenyl)pyridazin-3-yl]acetamide

N-[6-(2-hydroxyphenyl)pyridazin-3-yl]acetamide (PubChem CID 137045892) has the molecular formula C12H11N3O2 and a molecular weight of 229.24 g/mol. Its IUPAC name is N-[6-(2-hydroxyphenyl)pyridazin-3-yl]acetamide.

Molecular Properties

Compound NameN-[6-(2-hydroxyphenyl)pyridazin-3-yl]acetamide
PubChem CID137045892
Molecular FormulaC12H11N3O2
Molecular Weight229.24 g/mol
Exact Mass229.09
IUPAC NameN-[6-(2-hydroxyphenyl)pyridazin-3-yl]acetamide
SMILESCC(=O)Nc1ccc(-c2ccccc2O)nn1
InChIInChI=1S/C12H11N3O2/c1-8(16)13-12-7-6-10(14-15-12)9-4-2-3-5-11(9)17/h2-7,17H,1H3,(H,13,15,16)
InChIKeyQIIPAFJJLGMKGH-UHFFFAOYSA-N
XLogP1.81
TPSA75.11 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.24
LogP ≤ 51.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[6-(2-hydroxyphenyl)pyridazin-3-yl]acetamide?
The IUPAC name of N-[6-(2-hydroxyphenyl)pyridazin-3-yl]acetamide (CID 137045892) is N-[6-(2-hydroxyphenyl)pyridazin-3-yl]acetamide.
What is the SMILES notation for N-[6-(2-hydroxyphenyl)pyridazin-3-yl]acetamide?
The canonical SMILES for N-[6-(2-hydroxyphenyl)pyridazin-3-yl]acetamide is CC(=O)Nc1ccc(-c2ccccc2O)nn1.
What is the InChIKey of N-[6-(2-hydroxyphenyl)pyridazin-3-yl]acetamide?
The InChIKey is QIIPAFJJLGMKGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11N3O2/c1-8(16)13-12-7-6-10(14-15-12)9-4-2-3-5-11(9)17/h2-7,17H,1H3,(H,13,15,16).
What are the key properties of N-[6-(2-hydroxyphenyl)pyridazin-3-yl]acetamide?
N-[6-(2-hydroxyphenyl)pyridazin-3-yl]acetamide has a molecular weight of 229.24 g/mol, XLogP of 1.81, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(2-hydroxyphenyl)pyridazin-3-yl]acetamide is sourced from PubChem (CID 137045892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).