N-[(6-methylpyridazin-3-yl)methyl]acetamide

C8H11N3O — CID 110737862

IUPACN-[(6-methylpyridazin-3-yl)methyl]acetamide
SMILESCC(=O)NCc1ccc(C)nn1
InChIInChI=1S/C8H11N3O/c1-6-3-4-8(11-10-6)5-9-7(2)12/h3-4H,5H2,1-2H3,(H,9,12)
InChIKeyQXBLTUYOHYVERI-UHFFFAOYSA-N
MW165.20 g/mol
LogP0.42
Rot. Bonds2

About N-[(6-methylpyridazin-3-yl)methyl]acetamide

N-[(6-methylpyridazin-3-yl)methyl]acetamide (PubChem CID 110737862) has the molecular formula C8H11N3O and a molecular weight of 165.20 g/mol. Its IUPAC name is N-[(6-methylpyridazin-3-yl)methyl]acetamide.

Molecular Properties

Compound NameN-[(6-methylpyridazin-3-yl)methyl]acetamide
PubChem CID110737862
Molecular FormulaC8H11N3O
Molecular Weight165.20 g/mol
Exact Mass165.09
IUPAC NameN-[(6-methylpyridazin-3-yl)methyl]acetamide
SMILESCC(=O)NCc1ccc(C)nn1
InChIInChI=1S/C8H11N3O/c1-6-3-4-8(11-10-6)5-9-7(2)12/h3-4H,5H2,1-2H3,(H,9,12)
InChIKeyQXBLTUYOHYVERI-UHFFFAOYSA-N
XLogP0.42
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.20
LogP ≤ 50.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(6-methylpyridazin-3-yl)methyl]-2-sulfanylacetamide
CID 130901261
2-chloro-N-[(6-methylpyridazin-3-yl)methyl]propanamide
CID 127017343
2-(4-methylphenoxy)-N-[(6-methylpyridazin-3-yl)methyl]acetamide
CID 110737921
N-[(6-methylpyridazin-3-yl)methyl]-6-oxo-1H-pyridazine-3-carboxamide
CID 110746244
N-[(6-methylpyridazin-3-yl)methyl]-1,3-thiazolidine-4-carboxamide
CID 110746243
2-(3-chlorophenyl)-N-[(6-methylpyridazin-3-yl)methyl]acetamide
CID 110737958
3,4,5-trimethoxy-N-[(6-methylpyridazin-3-yl)methyl]benzamide
CID 110737899
3-(4-methoxyphenyl)-N-[(6-methylpyridazin-3-yl)methyl]propanamide
CID 110737936
4-acetyl-N-[(6-methylpyridazin-3-yl)methyl]benzenesulfonamide
CID 110738040
2-fluoro-4-(4-methylphenyl)-N-[(6-methylpyridazin-3-yl)methyl]benzamide
CID 166373491
N-[(6-methylpyrimidin-4-yl)methyl]acetamide
CID 122263436
3-(3-fluorophenyl)-N-[(6-methylpyridazin-3-yl)methyl]propanamide
CID 110737950

Frequently Asked Questions

What is the IUPAC name of N-[(6-methylpyridazin-3-yl)methyl]acetamide?
The IUPAC name of N-[(6-methylpyridazin-3-yl)methyl]acetamide (CID 110737862) is N-[(6-methylpyridazin-3-yl)methyl]acetamide.
What is the SMILES notation for N-[(6-methylpyridazin-3-yl)methyl]acetamide?
The canonical SMILES for N-[(6-methylpyridazin-3-yl)methyl]acetamide is CC(=O)NCc1ccc(C)nn1.
What is the InChIKey of N-[(6-methylpyridazin-3-yl)methyl]acetamide?
The InChIKey is QXBLTUYOHYVERI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N3O/c1-6-3-4-8(11-10-6)5-9-7(2)12/h3-4H,5H2,1-2H3,(H,9,12).
What are the key properties of N-[(6-methylpyridazin-3-yl)methyl]acetamide?
N-[(6-methylpyridazin-3-yl)methyl]acetamide has a molecular weight of 165.20 g/mol, XLogP of 0.42, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(6-methylpyridazin-3-yl)methyl]acetamide is sourced from PubChem (CID 110737862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).