2-[3-[6-[[(8R)-6-azaspiro[2.5]octan-8-yl]oxy]pyrazin-2-yl]-1-methylindazol-5-yl]propan-1-ol;tert-butyl (8R)-8-[6-[5-(1-hydroxypropan-2-yl)-1-methylindazol-3-yl]pyrazin-2-yl]oxy-6-azaspiro[2.5]octane-6-carboxylate;oxolane

C53H70N10O7 — CID 157334586

About 2-[3-[6-[[(8R)-6-azaspiro[2.5]octan-8-yl]oxy]pyrazin-2-yl]-1-methylindazol-5-yl]propan-1-ol;tert-butyl (8R)-8-[6-[5-(1-hydroxypropan-2-yl)-1-methylindazol-3-yl]pyrazin-2-yl]oxy-6-azaspiro[2.5]octane-6-carboxylate;oxolane

2-[3-[6-[[(8R)-6-azaspiro[2.5]octan-8-yl]oxy]pyrazin-2-yl]-1-methylindazol-5-yl]propan-1-ol;tert-butyl (8R)-8-[6-[5-(1-hydroxypropan-2-yl)-1-methylindazol-3-yl]pyrazin-2-yl]oxy-6-azaspiro[2.5]octane-6-carboxylate;oxolane (PubChem CID 157334586) has the molecular formula C53H70N10O7 and a molecular weight of 959.21 g/mol. Its IUPAC name is 2-[3-[6-[[(8R)-6-azaspiro[2.5]octan-8-yl]oxy]pyrazin-2-yl]-1-methylindazol-5-yl]propan-1-ol;tert-butyl (8R)-8-[6-[5-(1-hydroxypropan-2-yl)-1-methylindazol-3-yl]pyrazin-2-yl]oxy-6-azaspiro[2.5]octane-6-carboxylate;oxolane.

Molecular Properties

• Compound Name: 2-[3-[6-[[(8R)-6-azaspiro[2.5]octan-8-yl]oxy]pyrazin-2-yl]-1-methylindazol-5-yl]propan-1-ol;tert-butyl (8R)-8-[6-[5-(1-hydroxypropan-2-yl)-1-methylindazol-3-yl]pyrazin-2-yl]oxy-6-azaspiro[2.5]octane-6-carboxylate;oxolane
• PubChem CID: 157334586
• Molecular Formula: C53H70N10O7
• Molecular Weight: 959.21 g/mol
• Exact Mass: 958.54
• IUPAC Name: 2-[3-[6-[[(8R)-6-azaspiro[2.5]octan-8-yl]oxy]pyrazin-2-yl]-1-methylindazol-5-yl]propan-1-ol;tert-butyl (8R)-8-[6-[5-(1-hydroxypropan-2-yl)-1-methylindazol-3-yl]pyrazin-2-yl]oxy-6-azaspiro[2.5]octane-6-carboxylate;oxolane
• SMILES: C1CCOC1.CC(CO)c1ccc2c(c1)c(-c1cncc(O[C@H]3CN(C(=O)OC(C)(C)C)CCC34CC4)n1)nn2C.CC(CO)c1ccc2c(c1)c(-c1cncc(O[C@H]3CNCCC34CC4)n1)nn2C
• InChI: InChI=1S/C27H35N5O4.C22H27N5O2.C4H8O/c1-17(16-33)18-6-7-21-19(12-18)24(30-31(21)5)20-13-28-14-23(29-20)35-22-15-32(11-10-27(22)8-9-27)25(34)36-26(2,3)4;1-14(13-28)15-3-4-18-16(9-15)21(26-27(18)2)17-10-24-12-20(25-17)29-19-11-23-8-7-22(19)5-6-22;1-2-4-5-3-1/h6-7,12-14,17,22,33H,8-11,15-16H2,1-5H3;3-4,9-10,12,14,19,23,28H,5-8,11,13H2,1-2H3;1-4H2/t17?,22-;14?,19-;/m00./s1
• InChIKey: BFRNMJCOYJEEKI-FBUPLMILSA-N
• XLogP: 7.74
• TPSA: 196.92 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 16
• Rotatable Bonds: 10
• Heavy Atoms: 70
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	959.21
LogP ≤ 5	7.74
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	16

Frequently Asked Questions

What is the IUPAC name of 2-[3-[6-[[(8R)-6-azaspiro[2.5]octan-8-yl]oxy]pyrazin-2-yl]-1-methylindazol-5-yl]propan-1-ol;tert-butyl (8R)-8-[6-[5-(1-hydroxypropan-2-yl)-1-methylindazol-3-yl]pyrazin-2-yl]oxy-6-azaspiro[2.5]octane-6-carboxylate;oxolane?

The IUPAC name of 2-[3-[6-[[(8R)-6-azaspiro[2.5]octan-8-yl]oxy]pyrazin-2-yl]-1-methylindazol-5-yl]propan-1-ol;tert-butyl (8R)-8-[6-[5-(1-hydroxypropan-2-yl)-1-methylindazol-3-yl]pyrazin-2-yl]oxy-6-azaspiro[2.5]octane-6-carboxylate;oxolane (CID 157334586) is 2-[3-[6-[[(8R)-6-azaspiro[2.5]octan-8-yl]oxy]pyrazin-2-yl]-1-methylindazol-5-yl]propan-1-ol;tert-butyl (8R)-8-[6-[5-(1-hydroxypropan-2-yl)-1-methylindazol-3-yl]pyrazin-2-yl]oxy-6-azaspiro[2.5]octane-6-carboxylate;oxolane.

What is the SMILES notation for 2-[3-[6-[[(8R)-6-azaspiro[2.5]octan-8-yl]oxy]pyrazin-2-yl]-1-methylindazol-5-yl]propan-1-ol;tert-butyl (8R)-8-[6-[5-(1-hydroxypropan-2-yl)-1-methylindazol-3-yl]pyrazin-2-yl]oxy-6-azaspiro[2.5]octane-6-carboxylate;oxolane?

The canonical SMILES for 2-[3-[6-[[(8R)-6-azaspiro[2.5]octan-8-yl]oxy]pyrazin-2-yl]-1-methylindazol-5-yl]propan-1-ol;tert-butyl (8R)-8-[6-[5-(1-hydroxypropan-2-yl)-1-methylindazol-3-yl]pyrazin-2-yl]oxy-6-azaspiro[2.5]octane-6-carboxylate;oxolane is C1CCOC1.CC(CO)c1ccc2c(c1)c(-c1cncc(O[C@H]3CN(C(=O)OC(C)(C)C)CCC34CC4)n1)nn2C.CC(CO)c1ccc2c(c1)c(-c1cncc(O[C@H]3CNCCC34CC4)n1)nn2C.

What is the InChIKey of 2-[3-[6-[[(8R)-6-azaspiro[2.5]octan-8-yl]oxy]pyrazin-2-yl]-1-methylindazol-5-yl]propan-1-ol;tert-butyl (8R)-8-[6-[5-(1-hydroxypropan-2-yl)-1-methylindazol-3-yl]pyrazin-2-yl]oxy-6-azaspiro[2.5]octane-6-carboxylate;oxolane?

The InChIKey is BFRNMJCOYJEEKI-FBUPLMILSA-N. The full InChI is InChI=1S/C27H35N5O4.C22H27N5O2.C4H8O/c1-17(16-33)18-6-7-21-19(12-18)24(30-31(21)5)20-13-28-14-23(29-20)35-22-15-32(11-10-27(22)8-9-27)25(34)36-26(2,3)4;1-14(13-28)15-3-4-18-16(9-15)21(26-27(18)2)17-10-24-12-20(25-17)29-19-11-23-8-7-22(19)5-6-22;1-2-4-5-3-1/h6-7,12-14,17,22,33H,8-11,15-16H2,1-5H3;3-4,9-10,12,14,19,23,28H,5-8,11,13H2,1-2H3;1-4H2/t17?,22-;14?,19-;/m00./s1.

What are the key properties of 2-[3-[6-[[(8R)-6-azaspiro[2.5]octan-8-yl]oxy]pyrazin-2-yl]-1-methylindazol-5-yl]propan-1-ol;tert-butyl (8R)-8-[6-[5-(1-hydroxypropan-2-yl)-1-methylindazol-3-yl]pyrazin-2-yl]oxy-6-azaspiro[2.5]octane-6-carboxylate;oxolane?

2-[3-[6-[[(8R)-6-azaspiro[2.5]octan-8-yl]oxy]pyrazin-2-yl]-1-methylindazol-5-yl]propan-1-ol;tert-butyl (8R)-8-[6-[5-(1-hydroxypropan-2-yl)-1-methylindazol-3-yl]pyrazin-2-yl]oxy-6-azaspiro[2.5]octane-6-carboxylate;oxolane has a molecular weight of 959.21 g/mol, XLogP of 7.74, 10 rotatable bonds, 3 hydrogen bond donors, and 16 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[3-[6-[[(8R)-6-azaspiro[2.5]octan-8-yl]oxy]pyrazin-2-yl]-1-methylindazol-5-yl]propan-1-ol;tert-butyl (8R)-8-[6-[5-(1-hydroxypropan-2-yl)-1-methylindazol-3-yl]pyrazin-2-yl]oxy-6-azaspiro[2.5]octane-6-carboxylate;oxolane is sourced from PubChem (CID 157334586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).