2-propan-2-yl-2-azabicyclo[3.1.0]hexane;3-propan-2-yl-3-azabicyclo[3.1.0]hexane;2-propan-2-yl-2-azaspiro[3.3]heptane;4-propan-2-yl-4-azaspiro[2.4]heptane;5-propan-2-yl-5-azaspiro[2.4]heptane;1-propan-2-yl-1-azaspiro[4.4]nonane;6-propan-2-yl-6-azaspiro[3.5]nonane;5-propan-2-yl-5-azaspiro[2.5]octane;5-propan-2-yl-5-azaspiro[3.4]octane;6-propan-2-yl-6-azaspiro[2.5]octane;4-propan-2-yl-1H-indole;1-propan-2-yl-7-oxa-1-azaspiro[4.4]nonane;8-propan-2-yl-2-oxa-8-azaspiro[3.5]nonane

C126H231N13O2 — CID 158297963

About 2-propan-2-yl-2-azabicyclo[3.1.0]hexane;3-propan-2-yl-3-azabicyclo[3.1.0]hexane;2-propan-2-yl-2-azaspiro[3.3]heptane;4-propan-2-yl-4-azaspiro[2.4]heptane;5-propan-2-yl-5-azaspiro[2.4]heptane;1-propan-2-yl-1-azaspiro[4.4]nonane;6-propan-2-yl-6-azaspiro[3.5]nonane;5-propan-2-yl-5-azaspiro[2.5]octane;5-propan-2-yl-5-azaspiro[3.4]octane;6-propan-2-yl-6-azaspiro[2.5]octane;4-propan-2-yl-1H-indole;1-propan-2-yl-7-oxa-1-azaspiro[4.4]nonane;8-propan-2-yl-2-oxa-8-azaspiro[3.5]nonane

2-propan-2-yl-2-azabicyclo[3.1.0]hexane;3-propan-2-yl-3-azabicyclo[3.1.0]hexane;2-propan-2-yl-2-azaspiro[3.3]heptane;4-propan-2-yl-4-azaspiro[2.4]heptane;5-propan-2-yl-5-azaspiro[2.4]heptane;1-propan-2-yl-1-azaspiro[4.4]nonane;6-propan-2-yl-6-azaspiro[3.5]nonane;5-propan-2-yl-5-azaspiro[2.5]octane;5-propan-2-yl-5-azaspiro[3.4]octane;6-propan-2-yl-6-azaspiro[2.5]octane;4-propan-2-yl-1H-indole;1-propan-2-yl-7-oxa-1-azaspiro[4.4]nonane;8-propan-2-yl-2-oxa-8-azaspiro[3.5]nonane (PubChem CID 158297963) has the molecular formula C126H231N13O2 and a molecular weight of 1960.32 g/mol. Its IUPAC name is 2-propan-2-yl-2-azabicyclo[3.1.0]hexane;3-propan-2-yl-3-azabicyclo[3.1.0]hexane;2-propan-2-yl-2-azaspiro[3.3]heptane;4-propan-2-yl-4-azaspiro[2.4]heptane;5-propan-2-yl-5-azaspiro[2.4]heptane;1-propan-2-yl-1-azaspiro[4.4]nonane;6-propan-2-yl-6-azaspiro[3.5]nonane;5-propan-2-yl-5-azaspiro[2.5]octane;5-propan-2-yl-5-azaspiro[3.4]octane;6-propan-2-yl-6-azaspiro[2.5]octane;4-propan-2-yl-1H-indole;1-propan-2-yl-7-oxa-1-azaspiro[4.4]nonane;8-propan-2-yl-2-oxa-8-azaspiro[3.5]nonane.

Molecular Properties

• Compound Name: 2-propan-2-yl-2-azabicyclo[3.1.0]hexane;3-propan-2-yl-3-azabicyclo[3.1.0]hexane;2-propan-2-yl-2-azaspiro[3.3]heptane;4-propan-2-yl-4-azaspiro[2.4]heptane;5-propan-2-yl-5-azaspiro[2.4]heptane;1-propan-2-yl-1-azaspiro[4.4]nonane;6-propan-2-yl-6-azaspiro[3.5]nonane;5-propan-2-yl-5-azaspiro[2.5]octane;5-propan-2-yl-5-azaspiro[3.4]octane;6-propan-2-yl-6-azaspiro[2.5]octane;4-propan-2-yl-1H-indole;1-propan-2-yl-7-oxa-1-azaspiro[4.4]nonane;8-propan-2-yl-2-oxa-8-azaspiro[3.5]nonane
• PubChem CID: 158297963
• Molecular Formula: C126H231N13O2
• Molecular Weight: 1960.32 g/mol
• Exact Mass: 1958.84
• IUPAC Name: 2-propan-2-yl-2-azabicyclo[3.1.0]hexane;3-propan-2-yl-3-azabicyclo[3.1.0]hexane;2-propan-2-yl-2-azaspiro[3.3]heptane;4-propan-2-yl-4-azaspiro[2.4]heptane;5-propan-2-yl-5-azaspiro[2.4]heptane;1-propan-2-yl-1-azaspiro[4.4]nonane;6-propan-2-yl-6-azaspiro[3.5]nonane;5-propan-2-yl-5-azaspiro[2.5]octane;5-propan-2-yl-5-azaspiro[3.4]octane;6-propan-2-yl-6-azaspiro[2.5]octane;4-propan-2-yl-1H-indole;1-propan-2-yl-7-oxa-1-azaspiro[4.4]nonane;8-propan-2-yl-2-oxa-8-azaspiro[3.5]nonane
• SMILES: CC(C)N1CC2(CCC2)C1.CC(C)N1CC2CC2C1.CC(C)N1CCC2(CC1)CC2.CC(C)N1CCC2(CC2)C1.CC(C)N1CCC2CC21.CC(C)N1CCCC12CC2.CC(C)N1CCCC12CCC2.CC(C)N1CCCC12CCCC2.CC(C)N1CCCC12CCOC2.CC(C)N1CCCC2(CC2)C1.CC(C)N1CCCC2(CCC2)C1.CC(C)N1CCCC2(COC2)C1.CC(C)c1cccc2[nH]ccc12
• InChI: InChI=1S/2C11H21N.C11H13N.2C10H19NO.3C10H19N.3C9H17N.2C8H15N/c1-10(2)12-8-4-7-11(9-12)5-3-6-11;1-10(2)12-9-5-8-11(12)6-3-4-7-11;1-8(2)9-4-3-5-11-10(9)6-7-12-11;1-9(2)11-6-3-4-10(11)5-7-12-8-10;1-9(2)11-5-3-4-10(6-11)7-12-8-10;1-9(2)11-8-4-7-10(11)5-3-6-10;1-9(2)11-7-5-10(3-4-10)6-8-11;1-9(2)11-7-3-4-10(8-11)5-6-10;1-8(2)10-6-5-9(7-10)3-4-9;1-8(2)10-7-3-4-9(10)5-6-9;1-8(2)10-6-9(7-10)4-3-5-9;1-6(2)9-4-7-3-8(7)5-9;1-6(2)9-4-3-7-5-8(7)9/h2*10H,3-9H2,1-2H3;3-8,12H,1-2H3;2*9H,3-8H2,1-2H3;3*9H,3-8H2,1-2H3;3*8H,3-7H2,1-2H3;2*6-8H,3-5H2,1-2H3
• InChIKey: GMDJSRWFTUAWGV-UHFFFAOYSA-N
• XLogP: 27.49
• TPSA: 73.13 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 14
• Rotatable Bonds: 13
• Heavy Atoms: 141
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1960.32
LogP ≤ 5	27.49
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	14

Frequently Asked Questions

What is the IUPAC name of 2-propan-2-yl-2-azabicyclo[3.1.0]hexane;3-propan-2-yl-3-azabicyclo[3.1.0]hexane;2-propan-2-yl-2-azaspiro[3.3]heptane;4-propan-2-yl-4-azaspiro[2.4]heptane;5-propan-2-yl-5-azaspiro[2.4]heptane;1-propan-2-yl-1-azaspiro[4.4]nonane;6-propan-2-yl-6-azaspiro[3.5]nonane;5-propan-2-yl-5-azaspiro[2.5]octane;5-propan-2-yl-5-azaspiro[3.4]octane;6-propan-2-yl-6-azaspiro[2.5]octane;4-propan-2-yl-1H-indole;1-propan-2-yl-7-oxa-1-azaspiro[4.4]nonane;8-propan-2-yl-2-oxa-8-azaspiro[3.5]nonane?

The IUPAC name of 2-propan-2-yl-2-azabicyclo[3.1.0]hexane;3-propan-2-yl-3-azabicyclo[3.1.0]hexane;2-propan-2-yl-2-azaspiro[3.3]heptane;4-propan-2-yl-4-azaspiro[2.4]heptane;5-propan-2-yl-5-azaspiro[2.4]heptane;1-propan-2-yl-1-azaspiro[4.4]nonane;6-propan-2-yl-6-azaspiro[3.5]nonane;5-propan-2-yl-5-azaspiro[2.5]octane;5-propan-2-yl-5-azaspiro[3.4]octane;6-propan-2-yl-6-azaspiro[2.5]octane;4-propan-2-yl-1H-indole;1-propan-2-yl-7-oxa-1-azaspiro[4.4]nonane;8-propan-2-yl-2-oxa-8-azaspiro[3.5]nonane (CID 158297963) is 2-propan-2-yl-2-azabicyclo[3.1.0]hexane;3-propan-2-yl-3-azabicyclo[3.1.0]hexane;2-propan-2-yl-2-azaspiro[3.3]heptane;4-propan-2-yl-4-azaspiro[2.4]heptane;5-propan-2-yl-5-azaspiro[2.4]heptane;1-propan-2-yl-1-azaspiro[4.4]nonane;6-propan-2-yl-6-azaspiro[3.5]nonane;5-propan-2-yl-5-azaspiro[2.5]octane;5-propan-2-yl-5-azaspiro[3.4]octane;6-propan-2-yl-6-azaspiro[2.5]octane;4-propan-2-yl-1H-indole;1-propan-2-yl-7-oxa-1-azaspiro[4.4]nonane;8-propan-2-yl-2-oxa-8-azaspiro[3.5]nonane.

What is the SMILES notation for 2-propan-2-yl-2-azabicyclo[3.1.0]hexane;3-propan-2-yl-3-azabicyclo[3.1.0]hexane;2-propan-2-yl-2-azaspiro[3.3]heptane;4-propan-2-yl-4-azaspiro[2.4]heptane;5-propan-2-yl-5-azaspiro[2.4]heptane;1-propan-2-yl-1-azaspiro[4.4]nonane;6-propan-2-yl-6-azaspiro[3.5]nonane;5-propan-2-yl-5-azaspiro[2.5]octane;5-propan-2-yl-5-azaspiro[3.4]octane;6-propan-2-yl-6-azaspiro[2.5]octane;4-propan-2-yl-1H-indole;1-propan-2-yl-7-oxa-1-azaspiro[4.4]nonane;8-propan-2-yl-2-oxa-8-azaspiro[3.5]nonane?

The canonical SMILES for 2-propan-2-yl-2-azabicyclo[3.1.0]hexane;3-propan-2-yl-3-azabicyclo[3.1.0]hexane;2-propan-2-yl-2-azaspiro[3.3]heptane;4-propan-2-yl-4-azaspiro[2.4]heptane;5-propan-2-yl-5-azaspiro[2.4]heptane;1-propan-2-yl-1-azaspiro[4.4]nonane;6-propan-2-yl-6-azaspiro[3.5]nonane;5-propan-2-yl-5-azaspiro[2.5]octane;5-propan-2-yl-5-azaspiro[3.4]octane;6-propan-2-yl-6-azaspiro[2.5]octane;4-propan-2-yl-1H-indole;1-propan-2-yl-7-oxa-1-azaspiro[4.4]nonane;8-propan-2-yl-2-oxa-8-azaspiro[3.5]nonane is CC(C)N1CC2(CCC2)C1.CC(C)N1CC2CC2C1.CC(C)N1CCC2(CC1)CC2.CC(C)N1CCC2(CC2)C1.CC(C)N1CCC2CC21.CC(C)N1CCCC12CC2.CC(C)N1CCCC12CCC2.CC(C)N1CCCC12CCCC2.CC(C)N1CCCC12CCOC2.CC(C)N1CCCC2(CC2)C1.CC(C)N1CCCC2(CCC2)C1.CC(C)N1CCCC2(COC2)C1.CC(C)c1cccc2[nH]ccc12.

What is the InChIKey of 2-propan-2-yl-2-azabicyclo[3.1.0]hexane;3-propan-2-yl-3-azabicyclo[3.1.0]hexane;2-propan-2-yl-2-azaspiro[3.3]heptane;4-propan-2-yl-4-azaspiro[2.4]heptane;5-propan-2-yl-5-azaspiro[2.4]heptane;1-propan-2-yl-1-azaspiro[4.4]nonane;6-propan-2-yl-6-azaspiro[3.5]nonane;5-propan-2-yl-5-azaspiro[2.5]octane;5-propan-2-yl-5-azaspiro[3.4]octane;6-propan-2-yl-6-azaspiro[2.5]octane;4-propan-2-yl-1H-indole;1-propan-2-yl-7-oxa-1-azaspiro[4.4]nonane;8-propan-2-yl-2-oxa-8-azaspiro[3.5]nonane?

The InChIKey is GMDJSRWFTUAWGV-UHFFFAOYSA-N. The full InChI is InChI=1S/2C11H21N.C11H13N.2C10H19NO.3C10H19N.3C9H17N.2C8H15N/c1-10(2)12-8-4-7-11(9-12)5-3-6-11;1-10(2)12-9-5-8-11(12)6-3-4-7-11;1-8(2)9-4-3-5-11-10(9)6-7-12-11;1-9(2)11-6-3-4-10(11)5-7-12-8-10;1-9(2)11-5-3-4-10(6-11)7-12-8-10;1-9(2)11-8-4-7-10(11)5-3-6-10;1-9(2)11-7-5-10(3-4-10)6-8-11;1-9(2)11-7-3-4-10(8-11)5-6-10;1-8(2)10-6-5-9(7-10)3-4-9;1-8(2)10-7-3-4-9(10)5-6-9;1-8(2)10-6-9(7-10)4-3-5-9;1-6(2)9-4-7-3-8(7)5-9;1-6(2)9-4-3-7-5-8(7)9/h2*10H,3-9H2,1-2H3;3-8,12H,1-2H3;2*9H,3-8H2,1-2H3;3*9H,3-8H2,1-2H3;3*8H,3-7H2,1-2H3;2*6-8H,3-5H2,1-2H3.

What are the key properties of 2-propan-2-yl-2-azabicyclo[3.1.0]hexane;3-propan-2-yl-3-azabicyclo[3.1.0]hexane;2-propan-2-yl-2-azaspiro[3.3]heptane;4-propan-2-yl-4-azaspiro[2.4]heptane;5-propan-2-yl-5-azaspiro[2.4]heptane;1-propan-2-yl-1-azaspiro[4.4]nonane;6-propan-2-yl-6-azaspiro[3.5]nonane;5-propan-2-yl-5-azaspiro[2.5]octane;5-propan-2-yl-5-azaspiro[3.4]octane;6-propan-2-yl-6-azaspiro[2.5]octane;4-propan-2-yl-1H-indole;1-propan-2-yl-7-oxa-1-azaspiro[4.4]nonane;8-propan-2-yl-2-oxa-8-azaspiro[3.5]nonane?

2-propan-2-yl-2-azabicyclo[3.1.0]hexane;3-propan-2-yl-3-azabicyclo[3.1.0]hexane;2-propan-2-yl-2-azaspiro[3.3]heptane;4-propan-2-yl-4-azaspiro[2.4]heptane;5-propan-2-yl-5-azaspiro[2.4]heptane;1-propan-2-yl-1-azaspiro[4.4]nonane;6-propan-2-yl-6-azaspiro[3.5]nonane;5-propan-2-yl-5-azaspiro[2.5]octane;5-propan-2-yl-5-azaspiro[3.4]octane;6-propan-2-yl-6-azaspiro[2.5]octane;4-propan-2-yl-1H-indole;1-propan-2-yl-7-oxa-1-azaspiro[4.4]nonane;8-propan-2-yl-2-oxa-8-azaspiro[3.5]nonane has a molecular weight of 1960.32 g/mol, XLogP of 27.49, 13 rotatable bonds, 1 hydrogen bond donors, and 14 hydrogen bond acceptors.

Where does this data come from?

All data for 2-propan-2-yl-2-azabicyclo[3.1.0]hexane;3-propan-2-yl-3-azabicyclo[3.1.0]hexane;2-propan-2-yl-2-azaspiro[3.3]heptane;4-propan-2-yl-4-azaspiro[2.4]heptane;5-propan-2-yl-5-azaspiro[2.4]heptane;1-propan-2-yl-1-azaspiro[4.4]nonane;6-propan-2-yl-6-azaspiro[3.5]nonane;5-propan-2-yl-5-azaspiro[2.5]octane;5-propan-2-yl-5-azaspiro[3.4]octane;6-propan-2-yl-6-azaspiro[2.5]octane;4-propan-2-yl-1H-indole;1-propan-2-yl-7-oxa-1-azaspiro[4.4]nonane;8-propan-2-yl-2-oxa-8-azaspiro[3.5]nonane is sourced from PubChem (CID 158297963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).