2-(4,5-dichloro-6-oxopyridazin-1-yl)-N-propan-2-ylacetamide

C9H11Cl2N3O2 — CID 2585050

IUPAC2-(4,5-dichloro-6-oxopyridazin-1-yl)-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)Cn1ncc(Cl)c(Cl)c1=O
InChIInChI=1S/C9H11Cl2N3O2/c1-5(2)13-7(15)4-14-9(16)8(11)6(10)3-12-14/h3,5H,4H2,1-2H3,(H,13,15)
InChIKeyCZUCWUAFMFAKSE-UHFFFAOYSA-N
MW264.11 g/mol
LogP1.07
Rot. Bonds3

About 2-(4,5-dichloro-6-oxopyridazin-1-yl)-N-propan-2-ylacetamide

2-(4,5-dichloro-6-oxopyridazin-1-yl)-N-propan-2-ylacetamide (PubChem CID 2585050) 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-propan-2-ylacetamide.

Molecular Properties

Compound Name2-(4,5-dichloro-6-oxopyridazin-1-yl)-N-propan-2-ylacetamide
PubChem CID2585050
Molecular FormulaC9H11Cl2N3O2
Molecular Weight264.11 g/mol
Exact Mass263.02
IUPAC Name2-(4,5-dichloro-6-oxopyridazin-1-yl)-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)Cn1ncc(Cl)c(Cl)c1=O
InChIInChI=1S/C9H11Cl2N3O2/c1-5(2)13-7(15)4-14-9(16)8(11)6(10)3-12-14/h3,5H,4H2,1-2H3,(H,13,15)
InChIKeyCZUCWUAFMFAKSE-UHFFFAOYSA-N
XLogP1.07
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.11
LogP ≤ 51.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(4,5-dichloro-6-oxopyridazin-1-yl)-N-propan-2-ylacetamide?
The IUPAC name of 2-(4,5-dichloro-6-oxopyridazin-1-yl)-N-propan-2-ylacetamide (CID 2585050) is 2-(4,5-dichloro-6-oxopyridazin-1-yl)-N-propan-2-ylacetamide.
What is the SMILES notation for 2-(4,5-dichloro-6-oxopyridazin-1-yl)-N-propan-2-ylacetamide?
The canonical SMILES for 2-(4,5-dichloro-6-oxopyridazin-1-yl)-N-propan-2-ylacetamide is CC(C)NC(=O)Cn1ncc(Cl)c(Cl)c1=O.
What is the InChIKey of 2-(4,5-dichloro-6-oxopyridazin-1-yl)-N-propan-2-ylacetamide?
The InChIKey is CZUCWUAFMFAKSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11Cl2N3O2/c1-5(2)13-7(15)4-14-9(16)8(11)6(10)3-12-14/h3,5H,4H2,1-2H3,(H,13,15).
What are the key properties of 2-(4,5-dichloro-6-oxopyridazin-1-yl)-N-propan-2-ylacetamide?
2-(4,5-dichloro-6-oxopyridazin-1-yl)-N-propan-2-ylacetamide has a molecular weight of 264.11 g/mol, XLogP of 1.07, 3 rotatable bonds, 1 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-propan-2-ylacetamide is sourced from PubChem (CID 2585050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).