2-[6-(3-methylpiperidin-1-yl)pyridazin-3-yl]-5-(pyridin-2-ylmethylamino)pyridin-3-ol

C21H24N6O — CID 165038873

IUPAC2-[6-(3-methylpiperidin-1-yl)pyridazin-3-yl]-5-(pyridin-2-ylmethylamino)pyridin-3-ol
SMILESCC1CCCN(c2ccc(-c3ncc(NCc4ccccn4)cc3O)nn2)C1
InChIInChI=1S/C21H24N6O/c1-15-5-4-10-27(14-15)20-8-7-18(25-26-20)21-19(28)11-17(13-24-21)23-12-16-6-2-3-9-22-16/h2-3,6-9,11,13,15,23,28H,4-5,10,12,14H2,1H3
InChIKeyIREPIMFBZMIRLC-UHFFFAOYSA-N
MW376.46 g/mol
LogP3.49
Rot. Bonds5

About 2-[6-(3-methylpiperidin-1-yl)pyridazin-3-yl]-5-(pyridin-2-ylmethylamino)pyridin-3-ol

2-[6-(3-methylpiperidin-1-yl)pyridazin-3-yl]-5-(pyridin-2-ylmethylamino)pyridin-3-ol (PubChem CID 165038873) has the molecular formula C21H24N6O and a molecular weight of 376.46 g/mol. Its IUPAC name is 2-[6-(3-methylpiperidin-1-yl)pyridazin-3-yl]-5-(pyridin-2-ylmethylamino)pyridin-3-ol.

Molecular Properties

Compound Name2-[6-(3-methylpiperidin-1-yl)pyridazin-3-yl]-5-(pyridin-2-ylmethylamino)pyridin-3-ol
PubChem CID165038873
Molecular FormulaC21H24N6O
Molecular Weight376.46 g/mol
Exact Mass376.20
IUPAC Name2-[6-(3-methylpiperidin-1-yl)pyridazin-3-yl]-5-(pyridin-2-ylmethylamino)pyridin-3-ol
SMILESCC1CCCN(c2ccc(-c3ncc(NCc4ccccn4)cc3O)nn2)C1
InChIInChI=1S/C21H24N6O/c1-15-5-4-10-27(14-15)20-8-7-18(25-26-20)21-19(28)11-17(13-24-21)23-12-16-6-2-3-9-22-16/h2-3,6-9,11,13,15,23,28H,4-5,10,12,14H2,1H3
InChIKeyIREPIMFBZMIRLC-UHFFFAOYSA-N
XLogP3.49
TPSA87.06 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.46
LogP ≤ 53.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 2-[6-(3-methylpiperidin-1-yl)pyridazin-3-yl]-5-(pyridin-2-ylmethylamino)pyridin-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

2-[6-(3-methylpiperidin-1-yl)pyridazin-3-yl]-5-(pyridin-4-ylmethylamino)pyridin-3-ol
CID 165038871
2-[6-(3-methylpiperidin-1-yl)pyridazin-3-yl]-5-(pyridin-3-ylamino)pyridin-3-ol
CID 165040049
4-(3-methylpiperidin-1-yl)-6-phenyl-N-(pyridin-2-ylmethyl)pyrimidin-2-amine
CID 112937177
5-(7-methoxy-2-methylindazol-5-yl)-2-[6-(3-methylpiperidin-1-yl)pyridazin-3-yl]pyridin-3-ol
CID 165083380
2-[6-(2-azabicyclo[2.2.1]heptan-2-yl)pyridazin-3-yl]-5-(2-methylimidazo[1,2-a]pyrimidin-6-yl)pyridin-3-ol;2-[6-[(3S,5R)-3,5-dimethylpiperidin-1-yl]pyridazin-3-yl]-5-(2-methylimidazo[1,2-a]pyrimidin-6-yl)pyridin-3-ol;2-[6-(3-methylpiperidin-1-yl)pyridazin-3-yl]-5-(pyridin-3-ylamino)pyridin-3-ol
CID 165040048
(3S)-1-[6-(furan-2-yl)pyridazin-3-yl]-N-(pyridin-2-ylmethyl)piperidine-3-carboxamide
CID 30866511
2-[6-[(3R)-3-ethylpiperidin-1-yl]pyridazin-3-yl]-5-(1H-pyrazol-4-yl)pyridin-3-ol
CID 165053503
2-(3-methylpiperidin-1-yl)-N-(pyridin-2-ylmethyl)acetamide
CID 108999232
(3-methylpiperidin-1-yl)-[5-(pyridin-2-ylmethylamino)pyrazin-2-yl]methanone
CID 109283106
(4-methylazepan-1-yl)-[3-(pyridin-2-ylmethylamino)phenyl]methanone
CID 126820564
1-[6-(4-methylpiperidin-1-yl)pyridazin-3-yl]-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide
CID 50771156
2-[6-(2-azabicyclo[2.2.1]heptan-2-yl)pyridazin-3-yl]-5-(7-fluoro-2-methylindazol-5-yl)pyridin-3-ol;5-(7-fluoro-2-methylindazol-5-yl)-2-[6-[(3R)-3-methylpiperidin-1-yl]pyridazin-3-yl]pyridin-3-ol;5-(7-fluoro-2-methylindazol-5-yl)-2-[6-[(3S)-3-methylpiperidin-1-yl]pyridazin-3-yl]pyridin-3-ol
CID 164984253

Frequently Asked Questions

What is the IUPAC name of 2-[6-(3-methylpiperidin-1-yl)pyridazin-3-yl]-5-(pyridin-2-ylmethylamino)pyridin-3-ol?
The IUPAC name of 2-[6-(3-methylpiperidin-1-yl)pyridazin-3-yl]-5-(pyridin-2-ylmethylamino)pyridin-3-ol (CID 165038873) is 2-[6-(3-methylpiperidin-1-yl)pyridazin-3-yl]-5-(pyridin-2-ylmethylamino)pyridin-3-ol.
What is the SMILES notation for 2-[6-(3-methylpiperidin-1-yl)pyridazin-3-yl]-5-(pyridin-2-ylmethylamino)pyridin-3-ol?
The canonical SMILES for 2-[6-(3-methylpiperidin-1-yl)pyridazin-3-yl]-5-(pyridin-2-ylmethylamino)pyridin-3-ol is CC1CCCN(c2ccc(-c3ncc(NCc4ccccn4)cc3O)nn2)C1.
What is the InChIKey of 2-[6-(3-methylpiperidin-1-yl)pyridazin-3-yl]-5-(pyridin-2-ylmethylamino)pyridin-3-ol?
The InChIKey is IREPIMFBZMIRLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N6O/c1-15-5-4-10-27(14-15)20-8-7-18(25-26-20)21-19(28)11-17(13-24-21)23-12-16-6-2-3-9-22-16/h2-3,6-9,11,13,15,23,28H,4-5,10,12,14H2,1H3.
What are the key properties of 2-[6-(3-methylpiperidin-1-yl)pyridazin-3-yl]-5-(pyridin-2-ylmethylamino)pyridin-3-ol?
2-[6-(3-methylpiperidin-1-yl)pyridazin-3-yl]-5-(pyridin-2-ylmethylamino)pyridin-3-ol has a molecular weight of 376.46 g/mol, XLogP of 3.49, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-(3-methylpiperidin-1-yl)pyridazin-3-yl]-5-(pyridin-2-ylmethylamino)pyridin-3-ol is sourced from PubChem (CID 165038873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).