2-azaspiro[4.4]nonane;6-tert-butyl-2,3,4,4a,5,7,8,8a-octahydro-1H-2,6-naphthyridine;7-tert-butyl-1,2,3,4,6,7,8,8a-octahydropyrrolo[1,2-a]pyrazine;8-tert-butyl-2-azaspiro[4.5]decane;2-tert-butyl-5-azaspiro[2.4]heptane;7-tert-butyl-7-azaspiro[3.5]nonane;2-tert-butyl-6-azaspiro[3.4]octane;1,6-ditert-butyl-3,4,4a,5,7,7a-hexahydro-2H-pyrrolo[3,4-b]pyridine;2,7-ditert-butyl-1,3,4,4a,5,6,8,8a-octahydro-2,7-naphthyridine;2,6-ditert-butyl-6-azaspiro[2.5]octane;bis(2,2-dimethylpropane);hexakis(2-methylpropane)

C157H324N14 — CID 159574246

About 2-azaspiro[4.4]nonane;6-tert-butyl-2,3,4,4a,5,7,8,8a-octahydro-1H-2,6-naphthyridine;7-tert-butyl-1,2,3,4,6,7,8,8a-octahydropyrrolo[1,2-a]pyrazine;8-tert-butyl-2-azaspiro[4.5]decane;2-tert-butyl-5-azaspiro[2.4]heptane;7-tert-butyl-7-azaspiro[3.5]nonane;2-tert-butyl-6-azaspiro[3.4]octane;1,6-ditert-butyl-3,4,4a,5,7,7a-hexahydro-2H-pyrrolo[3,4-b]pyridine;2,7-ditert-butyl-1,3,4,4a,5,6,8,8a-octahydro-2,7-naphthyridine;2,6-ditert-butyl-6-azaspiro[2.5]octane;bis(2,2-dimethylpropane);hexakis(2-methylpropane)

2-azaspiro[4.4]nonane;6-tert-butyl-2,3,4,4a,5,7,8,8a-octahydro-1H-2,6-naphthyridine;7-tert-butyl-1,2,3,4,6,7,8,8a-octahydropyrrolo[1,2-a]pyrazine;8-tert-butyl-2-azaspiro[4.5]decane;2-tert-butyl-5-azaspiro[2.4]heptane;7-tert-butyl-7-azaspiro[3.5]nonane;2-tert-butyl-6-azaspiro[3.4]octane;1,6-ditert-butyl-3,4,4a,5,7,7a-hexahydro-2H-pyrrolo[3,4-b]pyridine;2,7-ditert-butyl-1,3,4,4a,5,6,8,8a-octahydro-2,7-naphthyridine;2,6-ditert-butyl-6-azaspiro[2.5]octane;bis(2,2-dimethylpropane);hexakis(2-methylpropane) (PubChem CID 159574246) has the molecular formula C157H324N14 and a molecular weight of 2408.42 g/mol. Its IUPAC name is 2-azaspiro[4.4]nonane;6-tert-butyl-2,3,4,4a,5,7,8,8a-octahydro-1H-2,6-naphthyridine;7-tert-butyl-1,2,3,4,6,7,8,8a-octahydropyrrolo[1,2-a]pyrazine;8-tert-butyl-2-azaspiro[4.5]decane;2-tert-butyl-5-azaspiro[2.4]heptane;7-tert-butyl-7-azaspiro[3.5]nonane;2-tert-butyl-6-azaspiro[3.4]octane;1,6-ditert-butyl-3,4,4a,5,7,7a-hexahydro-2H-pyrrolo[3,4-b]pyridine;2,7-ditert-butyl-1,3,4,4a,5,6,8,8a-octahydro-2,7-naphthyridine;2,6-ditert-butyl-6-azaspiro[2.5]octane;bis(2,2-dimethylpropane);hexakis(2-methylpropane).

Molecular Properties

• Compound Name: 2-azaspiro[4.4]nonane;6-tert-butyl-2,3,4,4a,5,7,8,8a-octahydro-1H-2,6-naphthyridine;7-tert-butyl-1,2,3,4,6,7,8,8a-octahydropyrrolo[1,2-a]pyrazine;8-tert-butyl-2-azaspiro[4.5]decane;2-tert-butyl-5-azaspiro[2.4]heptane;7-tert-butyl-7-azaspiro[3.5]nonane;2-tert-butyl-6-azaspiro[3.4]octane;1,6-ditert-butyl-3,4,4a,5,7,7a-hexahydro-2H-pyrrolo[3,4-b]pyridine;2,7-ditert-butyl-1,3,4,4a,5,6,8,8a-octahydro-2,7-naphthyridine;2,6-ditert-butyl-6-azaspiro[2.5]octane;bis(2,2-dimethylpropane);hexakis(2-methylpropane)
• PubChem CID: 159574246
• Molecular Formula: C157H324N14
• Molecular Weight: 2408.42 g/mol
• Exact Mass: 2406.58
• IUPAC Name: 2-azaspiro[4.4]nonane;6-tert-butyl-2,3,4,4a,5,7,8,8a-octahydro-1H-2,6-naphthyridine;7-tert-butyl-1,2,3,4,6,7,8,8a-octahydropyrrolo[1,2-a]pyrazine;8-tert-butyl-2-azaspiro[4.5]decane;2-tert-butyl-5-azaspiro[2.4]heptane;7-tert-butyl-7-azaspiro[3.5]nonane;2-tert-butyl-6-azaspiro[3.4]octane;1,6-ditert-butyl-3,4,4a,5,7,7a-hexahydro-2H-pyrrolo[3,4-b]pyridine;2,7-ditert-butyl-1,3,4,4a,5,6,8,8a-octahydro-2,7-naphthyridine;2,6-ditert-butyl-6-azaspiro[2.5]octane;bis(2,2-dimethylpropane);hexakis(2-methylpropane)
• SMILES: C1CCC2(C1)CCNC2.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C1CC12CCN(C(C)(C)C)CC2.CC(C)(C)C1CC12CCNC2.CC(C)(C)C1CC2(CCNC2)C1.CC(C)(C)C1CC2CNCCN2C1.CC(C)(C)C1CCC2(CCNC2)CC1.CC(C)(C)N1CC2CCCN(C(C)(C)C)C2C1.CC(C)(C)N1CCC2(CCC2)CC1.CC(C)(C)N1CCC2CCN(C(C)(C)C)CC2C1.CC(C)(C)N1CCC2CNCCC2C1.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC(C)C
• InChI: InChI=1S/C16H32N2.C15H30N2.C15H29N.C13H25N.C12H24N2.C12H23N.C11H22N2.C11H21N.C10H19N.C8H15N.2C5H12.6C4H10/c1-15(2,3)17-9-7-13-8-10-18(16(4,5)6)12-14(13)11-17;1-14(2,3)16-10-12-8-7-9-17(13(12)11-16)15(4,5)6;1-13(2,3)12-11-15(12)7-9-16(10-8-15)14(4,5)6;1-12(2,3)11-4-6-13(7-5-11)8-9-14-10-13;1-12(2,3)14-7-5-10-8-13-6-4-11(10)9-14;1-11(2,3)13-9-7-12(8-10-13)5-4-6-12;1-11(2,3)9-6-10-7-12-4-5-13(10)8-9;1-10(2,3)9-6-11(7-9)4-5-12-8-11;1-9(2,3)8-6-10(8)4-5-11-7-10;1-2-4-8(3-1)5-6-9-7-8;2*1-5(2,3)4;6*1-4(2)3/h13-14H,7-12H2,1-6H3;12-13H,7-11H2,1-6H3;12H,7-11H2,1-6H3;11,14H,4-10H2,1-3H3;10-11,13H,4-9H2,1-3H3;4-10H2,1-3H3;9-10,12H,4-8H2,1-3H3;9,12H,4-8H2,1-3H3;8,11H,4-7H2,1-3H3;9H,1-7H2;2*1-4H3;6*4H,1-3H3
• InChIKey: MIEUWEAYMJEOTK-UHFFFAOYSA-N
• XLogP: 39.51
• TPSA: 98.10 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 14
• Heavy Atoms: 171
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2408.42
LogP ≤ 5	39.51
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	14

Frequently Asked Questions

What is the IUPAC name of 2-azaspiro[4.4]nonane;6-tert-butyl-2,3,4,4a,5,7,8,8a-octahydro-1H-2,6-naphthyridine;7-tert-butyl-1,2,3,4,6,7,8,8a-octahydropyrrolo[1,2-a]pyrazine;8-tert-butyl-2-azaspiro[4.5]decane;2-tert-butyl-5-azaspiro[2.4]heptane;7-tert-butyl-7-azaspiro[3.5]nonane;2-tert-butyl-6-azaspiro[3.4]octane;1,6-ditert-butyl-3,4,4a,5,7,7a-hexahydro-2H-pyrrolo[3,4-b]pyridine;2,7-ditert-butyl-1,3,4,4a,5,6,8,8a-octahydro-2,7-naphthyridine;2,6-ditert-butyl-6-azaspiro[2.5]octane;bis(2,2-dimethylpropane);hexakis(2-methylpropane)?

The IUPAC name of 2-azaspiro[4.4]nonane;6-tert-butyl-2,3,4,4a,5,7,8,8a-octahydro-1H-2,6-naphthyridine;7-tert-butyl-1,2,3,4,6,7,8,8a-octahydropyrrolo[1,2-a]pyrazine;8-tert-butyl-2-azaspiro[4.5]decane;2-tert-butyl-5-azaspiro[2.4]heptane;7-tert-butyl-7-azaspiro[3.5]nonane;2-tert-butyl-6-azaspiro[3.4]octane;1,6-ditert-butyl-3,4,4a,5,7,7a-hexahydro-2H-pyrrolo[3,4-b]pyridine;2,7-ditert-butyl-1,3,4,4a,5,6,8,8a-octahydro-2,7-naphthyridine;2,6-ditert-butyl-6-azaspiro[2.5]octane;bis(2,2-dimethylpropane);hexakis(2-methylpropane) (CID 159574246) is 2-azaspiro[4.4]nonane;6-tert-butyl-2,3,4,4a,5,7,8,8a-octahydro-1H-2,6-naphthyridine;7-tert-butyl-1,2,3,4,6,7,8,8a-octahydropyrrolo[1,2-a]pyrazine;8-tert-butyl-2-azaspiro[4.5]decane;2-tert-butyl-5-azaspiro[2.4]heptane;7-tert-butyl-7-azaspiro[3.5]nonane;2-tert-butyl-6-azaspiro[3.4]octane;1,6-ditert-butyl-3,4,4a,5,7,7a-hexahydro-2H-pyrrolo[3,4-b]pyridine;2,7-ditert-butyl-1,3,4,4a,5,6,8,8a-octahydro-2,7-naphthyridine;2,6-ditert-butyl-6-azaspiro[2.5]octane;bis(2,2-dimethylpropane);hexakis(2-methylpropane).

What is the SMILES notation for 2-azaspiro[4.4]nonane;6-tert-butyl-2,3,4,4a,5,7,8,8a-octahydro-1H-2,6-naphthyridine;7-tert-butyl-1,2,3,4,6,7,8,8a-octahydropyrrolo[1,2-a]pyrazine;8-tert-butyl-2-azaspiro[4.5]decane;2-tert-butyl-5-azaspiro[2.4]heptane;7-tert-butyl-7-azaspiro[3.5]nonane;2-tert-butyl-6-azaspiro[3.4]octane;1,6-ditert-butyl-3,4,4a,5,7,7a-hexahydro-2H-pyrrolo[3,4-b]pyridine;2,7-ditert-butyl-1,3,4,4a,5,6,8,8a-octahydro-2,7-naphthyridine;2,6-ditert-butyl-6-azaspiro[2.5]octane;bis(2,2-dimethylpropane);hexakis(2-methylpropane)?

The canonical SMILES for 2-azaspiro[4.4]nonane;6-tert-butyl-2,3,4,4a,5,7,8,8a-octahydro-1H-2,6-naphthyridine;7-tert-butyl-1,2,3,4,6,7,8,8a-octahydropyrrolo[1,2-a]pyrazine;8-tert-butyl-2-azaspiro[4.5]decane;2-tert-butyl-5-azaspiro[2.4]heptane;7-tert-butyl-7-azaspiro[3.5]nonane;2-tert-butyl-6-azaspiro[3.4]octane;1,6-ditert-butyl-3,4,4a,5,7,7a-hexahydro-2H-pyrrolo[3,4-b]pyridine;2,7-ditert-butyl-1,3,4,4a,5,6,8,8a-octahydro-2,7-naphthyridine;2,6-ditert-butyl-6-azaspiro[2.5]octane;bis(2,2-dimethylpropane);hexakis(2-methylpropane) is C1CCC2(C1)CCNC2.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C1CC12CCN(C(C)(C)C)CC2.CC(C)(C)C1CC12CCNC2.CC(C)(C)C1CC2(CCNC2)C1.CC(C)(C)C1CC2CNCCN2C1.CC(C)(C)C1CCC2(CCNC2)CC1.CC(C)(C)N1CC2CCCN(C(C)(C)C)C2C1.CC(C)(C)N1CCC2(CCC2)CC1.CC(C)(C)N1CCC2CCN(C(C)(C)C)CC2C1.CC(C)(C)N1CCC2CNCCC2C1.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC(C)C.

What is the InChIKey of 2-azaspiro[4.4]nonane;6-tert-butyl-2,3,4,4a,5,7,8,8a-octahydro-1H-2,6-naphthyridine;7-tert-butyl-1,2,3,4,6,7,8,8a-octahydropyrrolo[1,2-a]pyrazine;8-tert-butyl-2-azaspiro[4.5]decane;2-tert-butyl-5-azaspiro[2.4]heptane;7-tert-butyl-7-azaspiro[3.5]nonane;2-tert-butyl-6-azaspiro[3.4]octane;1,6-ditert-butyl-3,4,4a,5,7,7a-hexahydro-2H-pyrrolo[3,4-b]pyridine;2,7-ditert-butyl-1,3,4,4a,5,6,8,8a-octahydro-2,7-naphthyridine;2,6-ditert-butyl-6-azaspiro[2.5]octane;bis(2,2-dimethylpropane);hexakis(2-methylpropane)?

The InChIKey is MIEUWEAYMJEOTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2.C15H30N2.C15H29N.C13H25N.C12H24N2.C12H23N.C11H22N2.C11H21N.C10H19N.C8H15N.2C5H12.6C4H10/c1-15(2,3)17-9-7-13-8-10-18(16(4,5)6)12-14(13)11-17;1-14(2,3)16-10-12-8-7-9-17(13(12)11-16)15(4,5)6;1-13(2,3)12-11-15(12)7-9-16(10-8-15)14(4,5)6;1-12(2,3)11-4-6-13(7-5-11)8-9-14-10-13;1-12(2,3)14-7-5-10-8-13-6-4-11(10)9-14;1-11(2,3)13-9-7-12(8-10-13)5-4-6-12;1-11(2,3)9-6-10-7-12-4-5-13(10)8-9;1-10(2,3)9-6-11(7-9)4-5-12-8-11;1-9(2,3)8-6-10(8)4-5-11-7-10;1-2-4-8(3-1)5-6-9-7-8;2*1-5(2,3)4;6*1-4(2)3/h13-14H,7-12H2,1-6H3;12-13H,7-11H2,1-6H3;12H,7-11H2,1-6H3;11,14H,4-10H2,1-3H3;10-11,13H,4-9H2,1-3H3;4-10H2,1-3H3;9-10,12H,4-8H2,1-3H3;9,12H,4-8H2,1-3H3;8,11H,4-7H2,1-3H3;9H,1-7H2;2*1-4H3;6*4H,1-3H3.

What are the key properties of 2-azaspiro[4.4]nonane;6-tert-butyl-2,3,4,4a,5,7,8,8a-octahydro-1H-2,6-naphthyridine;7-tert-butyl-1,2,3,4,6,7,8,8a-octahydropyrrolo[1,2-a]pyrazine;8-tert-butyl-2-azaspiro[4.5]decane;2-tert-butyl-5-azaspiro[2.4]heptane;7-tert-butyl-7-azaspiro[3.5]nonane;2-tert-butyl-6-azaspiro[3.4]octane;1,6-ditert-butyl-3,4,4a,5,7,7a-hexahydro-2H-pyrrolo[3,4-b]pyridine;2,7-ditert-butyl-1,3,4,4a,5,6,8,8a-octahydro-2,7-naphthyridine;2,6-ditert-butyl-6-azaspiro[2.5]octane;bis(2,2-dimethylpropane);hexakis(2-methylpropane)?

2-azaspiro[4.4]nonane;6-tert-butyl-2,3,4,4a,5,7,8,8a-octahydro-1H-2,6-naphthyridine;7-tert-butyl-1,2,3,4,6,7,8,8a-octahydropyrrolo[1,2-a]pyrazine;8-tert-butyl-2-azaspiro[4.5]decane;2-tert-butyl-5-azaspiro[2.4]heptane;7-tert-butyl-7-azaspiro[3.5]nonane;2-tert-butyl-6-azaspiro[3.4]octane;1,6-ditert-butyl-3,4,4a,5,7,7a-hexahydro-2H-pyrrolo[3,4-b]pyridine;2,7-ditert-butyl-1,3,4,4a,5,6,8,8a-octahydro-2,7-naphthyridine;2,6-ditert-butyl-6-azaspiro[2.5]octane;bis(2,2-dimethylpropane);hexakis(2-methylpropane) has a molecular weight of 2408.42 g/mol, XLogP of 39.51, 0 rotatable bonds, 6 hydrogen bond donors, and 14 hydrogen bond acceptors.

Where does this data come from?

All data for 2-azaspiro[4.4]nonane;6-tert-butyl-2,3,4,4a,5,7,8,8a-octahydro-1H-2,6-naphthyridine;7-tert-butyl-1,2,3,4,6,7,8,8a-octahydropyrrolo[1,2-a]pyrazine;8-tert-butyl-2-azaspiro[4.5]decane;2-tert-butyl-5-azaspiro[2.4]heptane;7-tert-butyl-7-azaspiro[3.5]nonane;2-tert-butyl-6-azaspiro[3.4]octane;1,6-ditert-butyl-3,4,4a,5,7,7a-hexahydro-2H-pyrrolo[3,4-b]pyridine;2,7-ditert-butyl-1,3,4,4a,5,6,8,8a-octahydro-2,7-naphthyridine;2,6-ditert-butyl-6-azaspiro[2.5]octane;bis(2,2-dimethylpropane);hexakis(2-methylpropane) is sourced from PubChem (CID 159574246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).