1-(3,6-dichloropyridazin-4-yl)-4-hydroxypyrrolidin-2-one

C8H7Cl2N3O2 — CID 168703833

IUPAC1-(3,6-dichloropyridazin-4-yl)-4-hydroxypyrrolidin-2-one
SMILESO=C1CC(O)CN1c1cc(Cl)nnc1Cl
InChIInChI=1S/C8H7Cl2N3O2/c9-6-2-5(8(10)12-11-6)13-3-4(14)1-7(13)15/h2,4,14H,1,3H2
InChIKeyJZEXJFDNMGBXFS-UHFFFAOYSA-N
MW248.07 g/mol
LogP0.88
Rot. Bonds1

About 1-(3,6-dichloropyridazin-4-yl)-4-hydroxypyrrolidin-2-one

1-(3,6-dichloropyridazin-4-yl)-4-hydroxypyrrolidin-2-one (PubChem CID 168703833) has the molecular formula C8H7Cl2N3O2 and a molecular weight of 248.07 g/mol. Its IUPAC name is 1-(3,6-dichloropyridazin-4-yl)-4-hydroxypyrrolidin-2-one.

Molecular Properties

Compound Name1-(3,6-dichloropyridazin-4-yl)-4-hydroxypyrrolidin-2-one
PubChem CID168703833
Molecular FormulaC8H7Cl2N3O2
Molecular Weight248.07 g/mol
Exact Mass246.99
IUPAC Name1-(3,6-dichloropyridazin-4-yl)-4-hydroxypyrrolidin-2-one
SMILESO=C1CC(O)CN1c1cc(Cl)nnc1Cl
InChIInChI=1S/C8H7Cl2N3O2/c9-6-2-5(8(10)12-11-6)13-3-4(14)1-7(13)15/h2,4,14H,1,3H2
InChIKeyJZEXJFDNMGBXFS-UHFFFAOYSA-N
XLogP0.88
TPSA66.32 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.07
LogP ≤ 50.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-(3,6-dichloropyridazin-4-yl)-4-hydroxypyrrolidin-2-one 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-chloro-1-(3,6-dichloropyridazin-4-yl)pyrrolidin-2-one
CID 168689693
1-(2,6-dichloro-4-pyridinyl)-4-hydroxypyrrolidin-2-one
CID 168703824
1-(6-chloro-4-methyl-3-pyridinyl)-4-hydroxypyrrolidin-2-one
CID 168702660
1-(6-chloro-3-pyridinyl)-4-hydroxypyrrolidin-2-one
CID 168703439
1-(3-chloro-2,4-difluorophenyl)-4-hydroxypyrrolidin-2-one
CID 168703206
1-(5-chloro-2-iodophenyl)-4-hydroxypyrrolidin-2-one
CID 168703303
1-(5-chloropyrimidin-2-yl)-4-hydroxypyrrolidin-2-one
CID 168703639
1-(2-chloro-4-methylpyrimidin-5-yl)-4-hydroxypyrrolidin-2-one
CID 168702593
1-(3-chloro-2-hydroxyphenyl)-4-hydroxypyrrolidin-2-one
CID 168703922
1-(2-amino-4-bromophenyl)-4-hydroxypyrrolidin-2-one
CID 168703480
1-[2-(aminomethyl)phenyl]-4-hydroxypyrrolidin-2-one
CID 168703041
5-chloro-2-(4-hydroxy-2-oxopyrrolidin-1-yl)benzonitrile
CID 168703507

Frequently Asked Questions

What is the IUPAC name of 1-(3,6-dichloropyridazin-4-yl)-4-hydroxypyrrolidin-2-one?
The IUPAC name of 1-(3,6-dichloropyridazin-4-yl)-4-hydroxypyrrolidin-2-one (CID 168703833) is 1-(3,6-dichloropyridazin-4-yl)-4-hydroxypyrrolidin-2-one.
What is the SMILES notation for 1-(3,6-dichloropyridazin-4-yl)-4-hydroxypyrrolidin-2-one?
The canonical SMILES for 1-(3,6-dichloropyridazin-4-yl)-4-hydroxypyrrolidin-2-one is O=C1CC(O)CN1c1cc(Cl)nnc1Cl.
What is the InChIKey of 1-(3,6-dichloropyridazin-4-yl)-4-hydroxypyrrolidin-2-one?
The InChIKey is JZEXJFDNMGBXFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7Cl2N3O2/c9-6-2-5(8(10)12-11-6)13-3-4(14)1-7(13)15/h2,4,14H,1,3H2.
What are the key properties of 1-(3,6-dichloropyridazin-4-yl)-4-hydroxypyrrolidin-2-one?
1-(3,6-dichloropyridazin-4-yl)-4-hydroxypyrrolidin-2-one has a molecular weight of 248.07 g/mol, XLogP of 0.88, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,6-dichloropyridazin-4-yl)-4-hydroxypyrrolidin-2-one is sourced from PubChem (CID 168703833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).