N-[5-(methoxymethyl)pyridazin-3-yl]acetamide

C8H11N3O2 — CID 166765527

IUPACN-[5-(methoxymethyl)pyridazin-3-yl]acetamide
SMILESCOCc1cnnc(NC(C)=O)c1
InChIInChI=1S/C8H11N3O2/c1-6(12)10-8-3-7(5-13-2)4-9-11-8/h3-4H,5H2,1-2H3,(H,10,11,12)
InChIKeyQIYWWEAORFLENF-UHFFFAOYSA-N
MW181.19 g/mol
LogP0.58
Rot. Bonds3

About N-[5-(methoxymethyl)pyridazin-3-yl]acetamide

N-[5-(methoxymethyl)pyridazin-3-yl]acetamide (PubChem CID 166765527) has the molecular formula C8H11N3O2 and a molecular weight of 181.19 g/mol. Its IUPAC name is N-[5-(methoxymethyl)pyridazin-3-yl]acetamide.

Molecular Properties

Compound NameN-[5-(methoxymethyl)pyridazin-3-yl]acetamide
PubChem CID166765527
Molecular FormulaC8H11N3O2
Molecular Weight181.19 g/mol
Exact Mass181.09
IUPAC NameN-[5-(methoxymethyl)pyridazin-3-yl]acetamide
SMILESCOCc1cnnc(NC(C)=O)c1
InChIInChI=1S/C8H11N3O2/c1-6(12)10-8-3-7(5-13-2)4-9-11-8/h3-4H,5H2,1-2H3,(H,10,11,12)
InChIKeyQIYWWEAORFLENF-UHFFFAOYSA-N
XLogP0.58
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.19
LogP ≤ 50.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-(methoxymethyl)-2-pyridinyl]acetamide
CID 59578573
[5-(methoxymethyl)-3-pyridinyl]methyl acetate
CID 54247300
N-[4-(aminooxymethyl)-2-pyridinyl]acetamide
CID 45119420
5-(methoxymethyl)-2-N-methylpyridine-2,3-dicarboxamide
CID 174324873
2-methoxycarbonyl-5-(methoxymethyl)pyridine-3-carboxylic acid
CID 67683783
N-(2,6-diacetamido-4-pyridinyl)acetamide
CID 69088952
methoxymethylbenzene;methyl acetate
CID 54330728
N-[2-[(5-methylpyridazin-3-yl)amino]ethyl]acetamide
CID 106549525
N-[4-[[4-(methoxymethyl)-6-methylsulfonyl-2-pyridinyl]amino]-5-(1-methylpyrazol-3-yl)-2-pyridinyl]acetamide
CID 166918499
N-[3,5-bis(methoxymethyl)phenyl]-2-(methylamino)acetamide
CID 145028711
(5-chloropyridazin-3-yl)carbamic acid
CID 89288358
2-[2-(dicarboxymethyl)-5-(methoxymethyl)-3-pyridinyl]propanedioic acid
CID 174432085

Frequently Asked Questions

What is the IUPAC name of N-[5-(methoxymethyl)pyridazin-3-yl]acetamide?
The IUPAC name of N-[5-(methoxymethyl)pyridazin-3-yl]acetamide (CID 166765527) is N-[5-(methoxymethyl)pyridazin-3-yl]acetamide.
What is the SMILES notation for N-[5-(methoxymethyl)pyridazin-3-yl]acetamide?
The canonical SMILES for N-[5-(methoxymethyl)pyridazin-3-yl]acetamide is COCc1cnnc(NC(C)=O)c1.
What is the InChIKey of N-[5-(methoxymethyl)pyridazin-3-yl]acetamide?
The InChIKey is QIYWWEAORFLENF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N3O2/c1-6(12)10-8-3-7(5-13-2)4-9-11-8/h3-4H,5H2,1-2H3,(H,10,11,12).
What are the key properties of N-[5-(methoxymethyl)pyridazin-3-yl]acetamide?
N-[5-(methoxymethyl)pyridazin-3-yl]acetamide has a molecular weight of 181.19 g/mol, XLogP of 0.58, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(methoxymethyl)pyridazin-3-yl]acetamide is sourced from PubChem (CID 166765527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).