3-[6-[[(8R)-6-azaspiro[2.5]octan-8-yl]oxy]pyrazin-2-yl]-5-phenyl-1H-indazole

C24H23N5O — CID 118725605

IUPAC3-[6-[[(8R)-6-azaspiro[2.5]octan-8-yl]oxy]pyrazin-2-yl]-5-phenyl-1H-indazole
SMILESc1ccc(-c2ccc3[nH]nc(-c4cncc(O[C@H]5CNCCC56CC6)n4)c3c2)cc1
InChIInChI=1S/C24H23N5O/c1-2-4-16(5-3-1)17-6-7-19-18(12-17)23(29-28-19)20-13-26-15-22(27-20)30-21-14-25-11-10-24(21)8-9-24/h1-7,12-13,15,21,25H,8-11,14H2,(H,28,29)/t21-/m0/s1
InChIKeyXHSLKDXAYGZSRO-NRFANRHFSA-N
MW397.48 g/mol
LogP4.21
Rot. Bonds4

About 3-[6-[[(8R)-6-azaspiro[2.5]octan-8-yl]oxy]pyrazin-2-yl]-5-phenyl-1H-indazole

3-[6-[[(8R)-6-azaspiro[2.5]octan-8-yl]oxy]pyrazin-2-yl]-5-phenyl-1H-indazole (PubChem CID 118725605) has the molecular formula C24H23N5O and a molecular weight of 397.48 g/mol. Its IUPAC name is 3-[6-[[(8R)-6-azaspiro[2.5]octan-8-yl]oxy]pyrazin-2-yl]-5-phenyl-1H-indazole.

Molecular Properties

Compound Name3-[6-[[(8R)-6-azaspiro[2.5]octan-8-yl]oxy]pyrazin-2-yl]-5-phenyl-1H-indazole
PubChem CID118725605
Molecular FormulaC24H23N5O
Molecular Weight397.48 g/mol
Exact Mass397.19
IUPAC Name3-[6-[[(8R)-6-azaspiro[2.5]octan-8-yl]oxy]pyrazin-2-yl]-5-phenyl-1H-indazole
SMILESc1ccc(-c2ccc3[nH]nc(-c4cncc(O[C@H]5CNCCC56CC6)n4)c3c2)cc1
InChIInChI=1S/C24H23N5O/c1-2-4-16(5-3-1)17-6-7-19-18(12-17)23(29-28-19)20-13-26-15-22(27-20)30-21-14-25-11-10-24(21)8-9-24/h1-7,12-13,15,21,25H,8-11,14H2,(H,28,29)/t21-/m0/s1
InChIKeyXHSLKDXAYGZSRO-NRFANRHFSA-N
XLogP4.21
TPSA75.72 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500397.48
LogP ≤ 54.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 3-[6-[[(8R)-6-azaspiro[2.5]octan-8-yl]oxy]pyrazin-2-yl]-5-phenyl-1H-indazole 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 3-[6-[[(8R)-6-azaspiro[2.5]octan-8-yl]oxy]pyrazin-2-yl]-5-phenyl-1H-indazole?
The IUPAC name of 3-[6-[[(8R)-6-azaspiro[2.5]octan-8-yl]oxy]pyrazin-2-yl]-5-phenyl-1H-indazole (CID 118725605) is 3-[6-[[(8R)-6-azaspiro[2.5]octan-8-yl]oxy]pyrazin-2-yl]-5-phenyl-1H-indazole.
What is the SMILES notation for 3-[6-[[(8R)-6-azaspiro[2.5]octan-8-yl]oxy]pyrazin-2-yl]-5-phenyl-1H-indazole?
The canonical SMILES for 3-[6-[[(8R)-6-azaspiro[2.5]octan-8-yl]oxy]pyrazin-2-yl]-5-phenyl-1H-indazole is c1ccc(-c2ccc3[nH]nc(-c4cncc(O[C@H]5CNCCC56CC6)n4)c3c2)cc1.
What is the InChIKey of 3-[6-[[(8R)-6-azaspiro[2.5]octan-8-yl]oxy]pyrazin-2-yl]-5-phenyl-1H-indazole?
The InChIKey is XHSLKDXAYGZSRO-NRFANRHFSA-N. The full InChI is InChI=1S/C24H23N5O/c1-2-4-16(5-3-1)17-6-7-19-18(12-17)23(29-28-19)20-13-26-15-22(27-20)30-21-14-25-11-10-24(21)8-9-24/h1-7,12-13,15,21,25H,8-11,14H2,(H,28,29)/t21-/m0/s1.
What are the key properties of 3-[6-[[(8R)-6-azaspiro[2.5]octan-8-yl]oxy]pyrazin-2-yl]-5-phenyl-1H-indazole?
3-[6-[[(8R)-6-azaspiro[2.5]octan-8-yl]oxy]pyrazin-2-yl]-5-phenyl-1H-indazole has a molecular weight of 397.48 g/mol, XLogP of 4.21, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[6-[[(8R)-6-azaspiro[2.5]octan-8-yl]oxy]pyrazin-2-yl]-5-phenyl-1H-indazole is sourced from PubChem (CID 118725605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).