2-(4,5-dichloro-6-oxopyridazin-1-yl)-N-ethyl-N-methylacetamide

C9H11Cl2N3O2 — CID 115580540

IUPAC2-(4,5-dichloro-6-oxopyridazin-1-yl)-N-ethyl-N-methylacetamide
SMILESCCN(C)C(=O)Cn1ncc(Cl)c(Cl)c1=O
InChIInChI=1S/C9H11Cl2N3O2/c1-3-13(2)7(15)5-14-9(16)8(11)6(10)4-12-14/h4H,3,5H2,1-2H3
InChIKeyXXAUXSCFBXJIHX-UHFFFAOYSA-N
MW264.11 g/mol
LogP1.03
Rot. Bonds3

About 2-(4,5-dichloro-6-oxopyridazin-1-yl)-N-ethyl-N-methylacetamide

2-(4,5-dichloro-6-oxopyridazin-1-yl)-N-ethyl-N-methylacetamide (PubChem CID 115580540) has the molecular formula C9H11Cl2N3O2 and a molecular weight of 264.11 g/mol. Its IUPAC name is 2-(4,5-dichloro-6-oxopyridazin-1-yl)-N-ethyl-N-methylacetamide.

Molecular Properties

Compound Name2-(4,5-dichloro-6-oxopyridazin-1-yl)-N-ethyl-N-methylacetamide
PubChem CID115580540
Molecular FormulaC9H11Cl2N3O2
Molecular Weight264.11 g/mol
Exact Mass263.02
IUPAC Name2-(4,5-dichloro-6-oxopyridazin-1-yl)-N-ethyl-N-methylacetamide
SMILESCCN(C)C(=O)Cn1ncc(Cl)c(Cl)c1=O
InChIInChI=1S/C9H11Cl2N3O2/c1-3-13(2)7(15)5-14-9(16)8(11)6(10)4-12-14/h4H,3,5H2,1-2H3
InChIKeyXXAUXSCFBXJIHX-UHFFFAOYSA-N
XLogP1.03
TPSA55.20 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.11
LogP ≤ 51.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-(4,5-dichloro-6-oxopyridazin-1-yl)-N-ethyl-N-methylacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4,5-dichloro-2-ethyl-3(2H)-pyridazinone
CID 676426
3(2H)-Pyridazinone, 4,5-dichloro-2-(2-(diethylamino)ethyl)-, monohydrochloride
CID 120473
3(2H)-Pyridazinone, 4,5-dichloro-2-(3-(dimethylamino)propyl)-, monohydrochloride
CID 209861
4,5-Dichloro-2-(2-oxopropyl)pyridazin-3-one
CID 5260661
2-[2-(Azepan-1-yl)-2-oxoethyl]-4,5-dichloropyridazin-3-one
CID 4826952
3(2H)-Pyridazinone, 4,5-dichloro-2-propyl-
CID 10655922
4,5-dichloro-2-[2-(diethylamino)ethyl]-3(2H)-pyridazinone
CID 120474
4,5-Dichloro-2-[3-(dimethylamino)propyl]pyridazin-3-one
CID 209862
2-(4,5-dichloro-6-oxo-1(6H)-pyridazinyl)-N,N,N-triethylethanaminium
CID 1040543
n-Butyl-2-(4,5-dichloro-6-oxopyridazin-1(6h)-yl)acetamide
CID 2082544
N-[2-(tert-butylamino)-2-oxoethyl]-2-(4,5-dichloro-6-oxopyridazin-1-yl)-N-methylacetamide
CID 9492186
2-(4,5-Dichloro-6-oxo-1,6-dihydropyridazin-1-yl)acetamide
CID 2585140

Frequently Asked Questions

What is the IUPAC name of 2-(4,5-dichloro-6-oxopyridazin-1-yl)-N-ethyl-N-methylacetamide?
The IUPAC name of 2-(4,5-dichloro-6-oxopyridazin-1-yl)-N-ethyl-N-methylacetamide (CID 115580540) is 2-(4,5-dichloro-6-oxopyridazin-1-yl)-N-ethyl-N-methylacetamide.
What is the SMILES notation for 2-(4,5-dichloro-6-oxopyridazin-1-yl)-N-ethyl-N-methylacetamide?
The canonical SMILES for 2-(4,5-dichloro-6-oxopyridazin-1-yl)-N-ethyl-N-methylacetamide is CCN(C)C(=O)Cn1ncc(Cl)c(Cl)c1=O.
What is the InChIKey of 2-(4,5-dichloro-6-oxopyridazin-1-yl)-N-ethyl-N-methylacetamide?
The InChIKey is XXAUXSCFBXJIHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11Cl2N3O2/c1-3-13(2)7(15)5-14-9(16)8(11)6(10)4-12-14/h4H,3,5H2,1-2H3.
What are the key properties of 2-(4,5-dichloro-6-oxopyridazin-1-yl)-N-ethyl-N-methylacetamide?
2-(4,5-dichloro-6-oxopyridazin-1-yl)-N-ethyl-N-methylacetamide has a molecular weight of 264.11 g/mol, XLogP of 1.03, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4,5-dichloro-6-oxopyridazin-1-yl)-N-ethyl-N-methylacetamide is sourced from PubChem (CID 115580540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).