1-[6-(oxan-4-yl)pyridazin-3-yl]pyrrolidin-3-ol

C13H19N3O2 — CID 116972911

IUPAC1-[6-(oxan-4-yl)pyridazin-3-yl]pyrrolidin-3-ol
SMILESOC1CCN(c2ccc(C3CCOCC3)nn2)C1
InChIInChI=1S/C13H19N3O2/c17-11-3-6-16(9-11)13-2-1-12(14-15-13)10-4-7-18-8-5-10/h1-2,10-11,17H,3-9H2
InChIKeyRWERNNZQZURUIZ-UHFFFAOYSA-N
MW249.31 g/mol
LogP0.94
Rot. Bonds2

About 1-[6-(oxan-4-yl)pyridazin-3-yl]pyrrolidin-3-ol

1-[6-(oxan-4-yl)pyridazin-3-yl]pyrrolidin-3-ol (PubChem CID 116972911) has the molecular formula C13H19N3O2 and a molecular weight of 249.31 g/mol. Its IUPAC name is 1-[6-(oxan-4-yl)pyridazin-3-yl]pyrrolidin-3-ol.

Molecular Properties

Compound Name1-[6-(oxan-4-yl)pyridazin-3-yl]pyrrolidin-3-ol
PubChem CID116972911
Molecular FormulaC13H19N3O2
Molecular Weight249.31 g/mol
Exact Mass249.15
IUPAC Name1-[6-(oxan-4-yl)pyridazin-3-yl]pyrrolidin-3-ol
SMILESOC1CCN(c2ccc(C3CCOCC3)nn2)C1
InChIInChI=1S/C13H19N3O2/c17-11-3-6-16(9-11)13-2-1-12(14-15-13)10-4-7-18-8-5-10/h1-2,10-11,17H,3-9H2
InChIKeyRWERNNZQZURUIZ-UHFFFAOYSA-N
XLogP0.94
TPSA58.48 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.31
LogP ≤ 50.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-[6-(oxan-4-yl)pyridazin-3-yl]pyrrolidin-3-ol 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

[1-(6-cyclopropylpyridazin-3-yl)pyrrolidin-3-yl]-morpholin-4-ylmethanone
CID 165434865
1-[6-(1-methylpyrrolidin-3-yl)pyridazin-3-yl]piperidin-4-ol
CID 116972763
1-[6-(1-methylpyrrolidin-3-yl)pyridazin-3-yl]piperidin-3-ol
CID 116972808
1-(6-cyclopropylpyridazin-3-yl)pyrrolidin-3-amine
CID 83832620
1-[6-(4-fluorophenyl)pyridazin-3-yl]pyrrolidin-3-ol
CID 56770273
3-cyclopropyl-6-[4-(trifluoromethyl)piperidin-1-yl]pyridazine
CID 171327910
1-(6-cyclobutylpyridazin-3-yl)-N-methylpyrrolidin-3-amine
CID 116972984
1-[6-(2-chlorophenyl)pyridazin-3-yl]pyrrolidin-3-ol
CID 3022107
1-[6-(1H-pyrrol-2-yl)pyridazin-3-yl]pyrrolidin-3-ol
CID 116972898
1-[6-(1,3-benzodioxol-5-yl)pyridazin-3-yl]pyrrolidin-3-ol
CID 56770770
[1-[6-(oxan-4-yl)pyridazin-3-yl]pyrrolidin-2-yl]methanamine
CID 116973042
1-[6-(3-methylphenyl)pyridazin-3-yl]pyrrolidin-3-ol
CID 56770780

Frequently Asked Questions

What is the IUPAC name of 1-[6-(oxan-4-yl)pyridazin-3-yl]pyrrolidin-3-ol?
The IUPAC name of 1-[6-(oxan-4-yl)pyridazin-3-yl]pyrrolidin-3-ol (CID 116972911) is 1-[6-(oxan-4-yl)pyridazin-3-yl]pyrrolidin-3-ol.
What is the SMILES notation for 1-[6-(oxan-4-yl)pyridazin-3-yl]pyrrolidin-3-ol?
The canonical SMILES for 1-[6-(oxan-4-yl)pyridazin-3-yl]pyrrolidin-3-ol is OC1CCN(c2ccc(C3CCOCC3)nn2)C1.
What is the InChIKey of 1-[6-(oxan-4-yl)pyridazin-3-yl]pyrrolidin-3-ol?
The InChIKey is RWERNNZQZURUIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O2/c17-11-3-6-16(9-11)13-2-1-12(14-15-13)10-4-7-18-8-5-10/h1-2,10-11,17H,3-9H2.
What are the key properties of 1-[6-(oxan-4-yl)pyridazin-3-yl]pyrrolidin-3-ol?
1-[6-(oxan-4-yl)pyridazin-3-yl]pyrrolidin-3-ol has a molecular weight of 249.31 g/mol, XLogP of 0.94, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[6-(oxan-4-yl)pyridazin-3-yl]pyrrolidin-3-ol is sourced from PubChem (CID 116972911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).