2-(1-methylimidazol-2-yl)-1-pyridazin-4-ylethanone

C10H10N4O — CID 105116274

IUPAC2-(1-methylimidazol-2-yl)-1-pyridazin-4-ylethanone
SMILESCn1ccnc1CC(=O)c1ccnnc1
InChIInChI=1S/C10H10N4O/c1-14-5-4-11-10(14)6-9(15)8-2-3-12-13-7-8/h2-5,7H,6H2,1H3
InChIKeyWFQDOUVRHOBCCD-UHFFFAOYSA-N
MW202.22 g/mol
LogP0.64
Rot. Bonds3

About 2-(1-methylimidazol-2-yl)-1-pyridazin-4-ylethanone

2-(1-methylimidazol-2-yl)-1-pyridazin-4-ylethanone (PubChem CID 105116274) has the molecular formula C10H10N4O and a molecular weight of 202.22 g/mol. Its IUPAC name is 2-(1-methylimidazol-2-yl)-1-pyridazin-4-ylethanone.

Molecular Properties

Compound Name2-(1-methylimidazol-2-yl)-1-pyridazin-4-ylethanone
PubChem CID105116274
Molecular FormulaC10H10N4O
Molecular Weight202.22 g/mol
Exact Mass202.09
IUPAC Name2-(1-methylimidazol-2-yl)-1-pyridazin-4-ylethanone
SMILESCn1ccnc1CC(=O)c1ccnnc1
InChIInChI=1S/C10H10N4O/c1-14-5-4-11-10(14)6-9(15)8-2-3-12-13-7-8/h2-5,7H,6H2,1H3
InChIKeyWFQDOUVRHOBCCD-UHFFFAOYSA-N
XLogP0.64
TPSA60.67 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.22
LogP ≤ 50.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-(1-methylimidazol-2-yl)-1-(4-methylsulfanylphenyl)ethanone
CID 12049984
2-(1-methylimidazol-2-yl)-1-[4-(trifluoromethyl)phenyl]ethanone
CID 115580311
1-(4-chloro-3-methylphenyl)-2-(1-methylimidazol-2-yl)ethanone
CID 115784448
2-(1-methylimidazol-2-yl)-1-pyridin-2-ylethanone
CID 112731558
1-(4-chloro-3-fluorophenyl)-2-(1-methylimidazol-2-yl)ethanone
CID 107996510
1-(4-fluoro-3-methoxyphenyl)-2-(1-methylimidazol-2-yl)ethanone
CID 115784488
1-(1,5-dimethylpyrazol-4-yl)-2-(1-methylimidazol-2-yl)ethanone
CID 105116318
2-(1-methylimidazol-2-yl)-1-(2-methylpyrimidin-4-yl)ethanone
CID 115529672
1-(5-bromofuran-2-yl)-2-(1-methylimidazol-2-yl)ethanone
CID 115784385
1-(5-bromothiophen-2-yl)-2-(1-methylimidazol-2-yl)ethanone
CID 112731562
1-(5-chlorothiophen-2-yl)-2-(1-methylimidazol-2-yl)ethanone
CID 115784458
2-(2-methylphenyl)-1-pyridazin-4-ylethanone
CID 105079516

Frequently Asked Questions

What is the IUPAC name of 2-(1-methylimidazol-2-yl)-1-pyridazin-4-ylethanone?
The IUPAC name of 2-(1-methylimidazol-2-yl)-1-pyridazin-4-ylethanone (CID 105116274) is 2-(1-methylimidazol-2-yl)-1-pyridazin-4-ylethanone.
What is the SMILES notation for 2-(1-methylimidazol-2-yl)-1-pyridazin-4-ylethanone?
The canonical SMILES for 2-(1-methylimidazol-2-yl)-1-pyridazin-4-ylethanone is Cn1ccnc1CC(=O)c1ccnnc1.
What is the InChIKey of 2-(1-methylimidazol-2-yl)-1-pyridazin-4-ylethanone?
The InChIKey is WFQDOUVRHOBCCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N4O/c1-14-5-4-11-10(14)6-9(15)8-2-3-12-13-7-8/h2-5,7H,6H2,1H3.
What are the key properties of 2-(1-methylimidazol-2-yl)-1-pyridazin-4-ylethanone?
2-(1-methylimidazol-2-yl)-1-pyridazin-4-ylethanone has a molecular weight of 202.22 g/mol, XLogP of 0.64, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methylimidazol-2-yl)-1-pyridazin-4-ylethanone is sourced from PubChem (CID 105116274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).