3-(6-piperidin-3-yloxypyrazin-2-yl)-5-pyridazin-3-yl-1H-indazole

C20H19N7O — CID 67960106

IUPAC3-(6-piperidin-3-yloxypyrazin-2-yl)-5-pyridazin-3-yl-1H-indazole
SMILESc1cnnc(-c2ccc3[nH]nc(-c4cncc(OC5CCCNC5)n4)c3c2)c1
InChIInChI=1S/C20H19N7O/c1-3-14(10-21-7-1)28-19-12-22-11-18(24-19)20-15-9-13(5-6-17(15)26-27-20)16-4-2-8-23-25-16/h2,4-6,8-9,11-12,14,21H,1,3,7,10H2,(H,26,27)
InChIKeyVYSPQJLIBHYCAH-UHFFFAOYSA-N
MW373.42 g/mol
LogP2.61
Rot. Bonds4

About 3-(6-piperidin-3-yloxypyrazin-2-yl)-5-pyridazin-3-yl-1H-indazole

3-(6-piperidin-3-yloxypyrazin-2-yl)-5-pyridazin-3-yl-1H-indazole (PubChem CID 67960106) has the molecular formula C20H19N7O and a molecular weight of 373.42 g/mol. Its IUPAC name is 3-(6-piperidin-3-yloxypyrazin-2-yl)-5-pyridazin-3-yl-1H-indazole.

Molecular Properties

Compound Name3-(6-piperidin-3-yloxypyrazin-2-yl)-5-pyridazin-3-yl-1H-indazole
PubChem CID67960106
Molecular FormulaC20H19N7O
Molecular Weight373.42 g/mol
Exact Mass373.17
IUPAC Name3-(6-piperidin-3-yloxypyrazin-2-yl)-5-pyridazin-3-yl-1H-indazole
SMILESc1cnnc(-c2ccc3[nH]nc(-c4cncc(OC5CCCNC5)n4)c3c2)c1
InChIInChI=1S/C20H19N7O/c1-3-14(10-21-7-1)28-19-12-22-11-18(24-19)20-15-9-13(5-6-17(15)26-27-20)16-4-2-8-23-25-16/h2,4-6,8-9,11-12,14,21H,1,3,7,10H2,(H,26,27)
InChIKeyVYSPQJLIBHYCAH-UHFFFAOYSA-N
XLogP2.61
TPSA101.50 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.42
LogP ≤ 52.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

5-phenyl-3-(6-piperidin-3-yloxypyrazin-2-yl)-1H-indazole
CID 67960084
5-(6-methoxy-2-pyridinyl)-3-(6-piperidin-3-yloxypyrazin-2-yl)-1H-indazole
CID 67960019
5-(2,6-difluorophenyl)-3-[6-[(3R)-piperidin-3-yl]oxypyrazin-2-yl]-1H-indazole
CID 67959597
5-(5-fluoro-3-pyridinyl)-3-(6-piperidin-3-yloxypyrazin-2-yl)-1H-indazole
CID 67960267
3-(6-piperidin-3-yloxypyrazin-2-yl)-5-(2-propan-2-yloxypyrimidin-4-yl)-1H-indazole
CID 67959774
5-(2,6-difluorophenyl)-3-[6-[(3S,4S)-4-methylpiperidin-3-yl]oxypyrazin-2-yl]-1H-indazole
CID 67959616
3-[6-[[(8R)-5-azaspiro[2.5]octan-8-yl]oxy]pyrazin-2-yl]-5-(6-cyclopropylpyrazin-2-yl)-1H-indazole
CID 57384133
5-(2,6-difluorophenyl)-3-[6-[(3R)-4,4-dimethylpiperidin-3-yl]oxypyrazin-2-yl]-1H-indazole
CID 67959780
5-[[3-(6-piperidin-3-yloxypyrazin-2-yl)phenyl]methylidene]-1,3-thiazole-2-thione
CID 164883551
3-[6-[[(8R)-6-azaspiro[2.5]octan-8-yl]oxy]pyrazin-2-yl]-5-(4-fluoro-3-pyridinyl)-1H-indazole
CID 118725607
3-[3-[6-[[(8R)-6-azaspiro[2.5]octan-8-yl]oxy]pyrazin-2-yl]-1H-indazol-5-yl]-N-cyclopropylbenzamide
CID 67960606
N-cyclopropyl-6-[3-(6-methoxypyrazin-2-yl)-1H-indazol-5-yl]pyrazin-2-amine
CID 57387439

Frequently Asked Questions

What is the IUPAC name of 3-(6-piperidin-3-yloxypyrazin-2-yl)-5-pyridazin-3-yl-1H-indazole?
The IUPAC name of 3-(6-piperidin-3-yloxypyrazin-2-yl)-5-pyridazin-3-yl-1H-indazole (CID 67960106) is 3-(6-piperidin-3-yloxypyrazin-2-yl)-5-pyridazin-3-yl-1H-indazole.
What is the SMILES notation for 3-(6-piperidin-3-yloxypyrazin-2-yl)-5-pyridazin-3-yl-1H-indazole?
The canonical SMILES for 3-(6-piperidin-3-yloxypyrazin-2-yl)-5-pyridazin-3-yl-1H-indazole is c1cnnc(-c2ccc3[nH]nc(-c4cncc(OC5CCCNC5)n4)c3c2)c1.
What is the InChIKey of 3-(6-piperidin-3-yloxypyrazin-2-yl)-5-pyridazin-3-yl-1H-indazole?
The InChIKey is VYSPQJLIBHYCAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N7O/c1-3-14(10-21-7-1)28-19-12-22-11-18(24-19)20-15-9-13(5-6-17(15)26-27-20)16-4-2-8-23-25-16/h2,4-6,8-9,11-12,14,21H,1,3,7,10H2,(H,26,27).
What are the key properties of 3-(6-piperidin-3-yloxypyrazin-2-yl)-5-pyridazin-3-yl-1H-indazole?
3-(6-piperidin-3-yloxypyrazin-2-yl)-5-pyridazin-3-yl-1H-indazole has a molecular weight of 373.42 g/mol, XLogP of 2.61, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(6-piperidin-3-yloxypyrazin-2-yl)-5-pyridazin-3-yl-1H-indazole is sourced from PubChem (CID 67960106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).