2,3,4,6,7,8,9,9a-octahydro-1H-pyrido[1,2-a]pyrazine;2-azaspiro[3.3]heptane;2-azaspiro[3.5]nonane;2-azaspiro[3.4]octane;1-(1-tert-butyl-1,6-diazaspiro[3.3]heptan-6-yl)ethanone;1-tert-butyl-6-methylidene-6λ6-thia-1-azaspiro[3.3]heptane 6-oxide;1-(2,6-diazaspiro[3.3]heptan-2-yl)ethanone;decakis(2-methylpropane);2-oxa-6-azaspiro[4.5]decane;2-oxa-9-azaspiro[4.5]decane;2-oxa-5-azaspiro[3.5]nonane;2-oxa-8-azaspiro[3.5]nonane;5-oxa-2-azaspiro[3.4]octane

C133H273N15O8S — CID 160690656

About 2,3,4,6,7,8,9,9a-octahydro-1H-pyrido[1,2-a]pyrazine;2-azaspiro[3.3]heptane;2-azaspiro[3.5]nonane;2-azaspiro[3.4]octane;1-(1-tert-butyl-1,6-diazaspiro[3.3]heptan-6-yl)ethanone;1-tert-butyl-6-methylidene-6λ6-thia-1-azaspiro[3.3]heptane 6-oxide;1-(2,6-diazaspiro[3.3]heptan-2-yl)ethanone;decakis(2-methylpropane);2-oxa-6-azaspiro[4.5]decane;2-oxa-9-azaspiro[4.5]decane;2-oxa-5-azaspiro[3.5]nonane;2-oxa-8-azaspiro[3.5]nonane;5-oxa-2-azaspiro[3.4]octane

2,3,4,6,7,8,9,9a-octahydro-1H-pyrido[1,2-a]pyrazine;2-azaspiro[3.3]heptane;2-azaspiro[3.5]nonane;2-azaspiro[3.4]octane;1-(1-tert-butyl-1,6-diazaspiro[3.3]heptan-6-yl)ethanone;1-tert-butyl-6-methylidene-6λ6-thia-1-azaspiro[3.3]heptane 6-oxide;1-(2,6-diazaspiro[3.3]heptan-2-yl)ethanone;decakis(2-methylpropane);2-oxa-6-azaspiro[4.5]decane;2-oxa-9-azaspiro[4.5]decane;2-oxa-5-azaspiro[3.5]nonane;2-oxa-8-azaspiro[3.5]nonane;5-oxa-2-azaspiro[3.4]octane (PubChem CID 160690656) has the molecular formula C133H273N15O8S and a molecular weight of 2242.81 g/mol. Its IUPAC name is 2,3,4,6,7,8,9,9a-octahydro-1H-pyrido[1,2-a]pyrazine;2-azaspiro[3.3]heptane;2-azaspiro[3.5]nonane;2-azaspiro[3.4]octane;1-(1-tert-butyl-1,6-diazaspiro[3.3]heptan-6-yl)ethanone;1-tert-butyl-6-methylidene-6λ6-thia-1-azaspiro[3.3]heptane 6-oxide;1-(2,6-diazaspiro[3.3]heptan-2-yl)ethanone;decakis(2-methylpropane);2-oxa-6-azaspiro[4.5]decane;2-oxa-9-azaspiro[4.5]decane;2-oxa-5-azaspiro[3.5]nonane;2-oxa-8-azaspiro[3.5]nonane;5-oxa-2-azaspiro[3.4]octane.

Molecular Properties

• Compound Name: 2,3,4,6,7,8,9,9a-octahydro-1H-pyrido[1,2-a]pyrazine;2-azaspiro[3.3]heptane;2-azaspiro[3.5]nonane;2-azaspiro[3.4]octane;1-(1-tert-butyl-1,6-diazaspiro[3.3]heptan-6-yl)ethanone;1-tert-butyl-6-methylidene-6λ6-thia-1-azaspiro[3.3]heptane 6-oxide;1-(2,6-diazaspiro[3.3]heptan-2-yl)ethanone;decakis(2-methylpropane);2-oxa-6-azaspiro[4.5]decane;2-oxa-9-azaspiro[4.5]decane;2-oxa-5-azaspiro[3.5]nonane;2-oxa-8-azaspiro[3.5]nonane;5-oxa-2-azaspiro[3.4]octane
• PubChem CID: 160690656
• Molecular Formula: C133H273N15O8S
• Molecular Weight: 2242.81 g/mol
• Exact Mass: 2241.11
• IUPAC Name: 2,3,4,6,7,8,9,9a-octahydro-1H-pyrido[1,2-a]pyrazine;2-azaspiro[3.3]heptane;2-azaspiro[3.5]nonane;2-azaspiro[3.4]octane;1-(1-tert-butyl-1,6-diazaspiro[3.3]heptan-6-yl)ethanone;1-tert-butyl-6-methylidene-6λ6-thia-1-azaspiro[3.3]heptane 6-oxide;1-(2,6-diazaspiro[3.3]heptan-2-yl)ethanone;decakis(2-methylpropane);2-oxa-6-azaspiro[4.5]decane;2-oxa-9-azaspiro[4.5]decane;2-oxa-5-azaspiro[3.5]nonane;2-oxa-8-azaspiro[3.5]nonane;5-oxa-2-azaspiro[3.4]octane
• SMILES: C1CC2(C1)CNC2.C1CCC2(C1)CNC2.C1CCC2(CC1)CNC2.C1CCC2(CCOC2)NC1.C1CCC2(COC2)NC1.C1CCN2CCNCC2C1.C1CNCC2(C1)CCOC2.C1CNCC2(C1)COC2.C1COC2(C1)CNC2.C=S1(=O)CC2(CCN2C(C)(C)C)C1.CC(=O)N1CC2(CCN2C(C)(C)C)C1.CC(=O)N1CC2(CNC2)C1.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC(C)C
• InChI: InChI=1S/C11H20N2O.C10H19NOS.C8H16N2.2C8H15NO.C8H15N.C7H12N2O.2C7H13NO.C7H13N.C6H11NO.C6H11N.10C4H10/c1-9(14)12-7-11(8-12)5-6-13(11)10(2,3)4;1-9(2,3)11-6-5-10(11)7-13(4,12)8-10;1-2-5-10-6-4-9-7-8(10)3-1;1-2-8(6-9-4-1)3-5-10-7-8;1-2-5-9-8(3-1)4-6-10-7-8;1-2-4-8(5-3-1)6-9-7-8;1-6(10)9-4-7(5-9)2-8-3-7;1-2-7(4-8-3-1)5-9-6-7;1-2-4-8-7(3-1)5-9-6-7;1-2-4-7(3-1)5-8-6-7;1-2-6(8-3-1)4-7-5-6;1-2-6(3-1)4-7-5-6;10*1-4(2)3/h5-8H2,1-4H3;4-8H2,1-3H3;8-9H,1-7H2;2*9H,1-7H2;9H,1-7H2;8H,2-5H2,1H3;2*8H,1-6H2;8H,1-6H2;7H,1-5H2;7H,1-5H2;10*4H,1-3H3
• InChIKey: RPJBFWIMYVTGBJ-UHFFFAOYSA-N
• XLogP: 24.76
• TPSA: 233.86 Ų
• H-Bond Donors: 10
• H-Bond Acceptors: 21
• Heavy Atoms: 157
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2242.81
LogP ≤ 5	24.76
H-Bond Donors ≤ 5	10
H-Bond Acceptors ≤ 10	21

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Thiocarbonyl_group', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2,3,4,6,7,8,9,9a-octahydro-1H-pyrido[1,2-a]pyrazine;2-azaspiro[3.3]heptane;2-azaspiro[3.5]nonane;2-azaspiro[3.4]octane;1-(1-tert-butyl-1,6-diazaspiro[3.3]heptan-6-yl)ethanone;1-tert-butyl-6-methylidene-6λ6-thia-1-azaspiro[3.3]heptane 6-oxide;1-(2,6-diazaspiro[3.3]heptan-2-yl)ethanone;decakis(2-methylpropane);2-oxa-6-azaspiro[4.5]decane;2-oxa-9-azaspiro[4.5]decane;2-oxa-5-azaspiro[3.5]nonane;2-oxa-8-azaspiro[3.5]nonane;5-oxa-2-azaspiro[3.4]octane?

The IUPAC name of 2,3,4,6,7,8,9,9a-octahydro-1H-pyrido[1,2-a]pyrazine;2-azaspiro[3.3]heptane;2-azaspiro[3.5]nonane;2-azaspiro[3.4]octane;1-(1-tert-butyl-1,6-diazaspiro[3.3]heptan-6-yl)ethanone;1-tert-butyl-6-methylidene-6λ6-thia-1-azaspiro[3.3]heptane 6-oxide;1-(2,6-diazaspiro[3.3]heptan-2-yl)ethanone;decakis(2-methylpropane);2-oxa-6-azaspiro[4.5]decane;2-oxa-9-azaspiro[4.5]decane;2-oxa-5-azaspiro[3.5]nonane;2-oxa-8-azaspiro[3.5]nonane;5-oxa-2-azaspiro[3.4]octane (CID 160690656) is 2,3,4,6,7,8,9,9a-octahydro-1H-pyrido[1,2-a]pyrazine;2-azaspiro[3.3]heptane;2-azaspiro[3.5]nonane;2-azaspiro[3.4]octane;1-(1-tert-butyl-1,6-diazaspiro[3.3]heptan-6-yl)ethanone;1-tert-butyl-6-methylidene-6λ6-thia-1-azaspiro[3.3]heptane 6-oxide;1-(2,6-diazaspiro[3.3]heptan-2-yl)ethanone;decakis(2-methylpropane);2-oxa-6-azaspiro[4.5]decane;2-oxa-9-azaspiro[4.5]decane;2-oxa-5-azaspiro[3.5]nonane;2-oxa-8-azaspiro[3.5]nonane;5-oxa-2-azaspiro[3.4]octane.

What is the SMILES notation for 2,3,4,6,7,8,9,9a-octahydro-1H-pyrido[1,2-a]pyrazine;2-azaspiro[3.3]heptane;2-azaspiro[3.5]nonane;2-azaspiro[3.4]octane;1-(1-tert-butyl-1,6-diazaspiro[3.3]heptan-6-yl)ethanone;1-tert-butyl-6-methylidene-6λ6-thia-1-azaspiro[3.3]heptane 6-oxide;1-(2,6-diazaspiro[3.3]heptan-2-yl)ethanone;decakis(2-methylpropane);2-oxa-6-azaspiro[4.5]decane;2-oxa-9-azaspiro[4.5]decane;2-oxa-5-azaspiro[3.5]nonane;2-oxa-8-azaspiro[3.5]nonane;5-oxa-2-azaspiro[3.4]octane?

The canonical SMILES for 2,3,4,6,7,8,9,9a-octahydro-1H-pyrido[1,2-a]pyrazine;2-azaspiro[3.3]heptane;2-azaspiro[3.5]nonane;2-azaspiro[3.4]octane;1-(1-tert-butyl-1,6-diazaspiro[3.3]heptan-6-yl)ethanone;1-tert-butyl-6-methylidene-6λ6-thia-1-azaspiro[3.3]heptane 6-oxide;1-(2,6-diazaspiro[3.3]heptan-2-yl)ethanone;decakis(2-methylpropane);2-oxa-6-azaspiro[4.5]decane;2-oxa-9-azaspiro[4.5]decane;2-oxa-5-azaspiro[3.5]nonane;2-oxa-8-azaspiro[3.5]nonane;5-oxa-2-azaspiro[3.4]octane is C1CC2(C1)CNC2.C1CCC2(C1)CNC2.C1CCC2(CC1)CNC2.C1CCC2(CCOC2)NC1.C1CCC2(COC2)NC1.C1CCN2CCNCC2C1.C1CNCC2(C1)CCOC2.C1CNCC2(C1)COC2.C1COC2(C1)CNC2.C=S1(=O)CC2(CCN2C(C)(C)C)C1.CC(=O)N1CC2(CCN2C(C)(C)C)C1.CC(=O)N1CC2(CNC2)C1.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC(C)C.

What is the InChIKey of 2,3,4,6,7,8,9,9a-octahydro-1H-pyrido[1,2-a]pyrazine;2-azaspiro[3.3]heptane;2-azaspiro[3.5]nonane;2-azaspiro[3.4]octane;1-(1-tert-butyl-1,6-diazaspiro[3.3]heptan-6-yl)ethanone;1-tert-butyl-6-methylidene-6λ6-thia-1-azaspiro[3.3]heptane 6-oxide;1-(2,6-diazaspiro[3.3]heptan-2-yl)ethanone;decakis(2-methylpropane);2-oxa-6-azaspiro[4.5]decane;2-oxa-9-azaspiro[4.5]decane;2-oxa-5-azaspiro[3.5]nonane;2-oxa-8-azaspiro[3.5]nonane;5-oxa-2-azaspiro[3.4]octane?

The InChIKey is RPJBFWIMYVTGBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O.C10H19NOS.C8H16N2.2C8H15NO.C8H15N.C7H12N2O.2C7H13NO.C7H13N.C6H11NO.C6H11N.10C4H10/c1-9(14)12-7-11(8-12)5-6-13(11)10(2,3)4;1-9(2,3)11-6-5-10(11)7-13(4,12)8-10;1-2-5-10-6-4-9-7-8(10)3-1;1-2-8(6-9-4-1)3-5-10-7-8;1-2-5-9-8(3-1)4-6-10-7-8;1-2-4-8(5-3-1)6-9-7-8;1-6(10)9-4-7(5-9)2-8-3-7;1-2-7(4-8-3-1)5-9-6-7;1-2-4-8-7(3-1)5-9-6-7;1-2-4-7(3-1)5-8-6-7;1-2-6(8-3-1)4-7-5-6;1-2-6(3-1)4-7-5-6;10*1-4(2)3/h5-8H2,1-4H3;4-8H2,1-3H3;8-9H,1-7H2;2*9H,1-7H2;9H,1-7H2;8H,2-5H2,1H3;2*8H,1-6H2;8H,1-6H2;7H,1-5H2;7H,1-5H2;10*4H,1-3H3.

What are the key properties of 2,3,4,6,7,8,9,9a-octahydro-1H-pyrido[1,2-a]pyrazine;2-azaspiro[3.3]heptane;2-azaspiro[3.5]nonane;2-azaspiro[3.4]octane;1-(1-tert-butyl-1,6-diazaspiro[3.3]heptan-6-yl)ethanone;1-tert-butyl-6-methylidene-6λ6-thia-1-azaspiro[3.3]heptane 6-oxide;1-(2,6-diazaspiro[3.3]heptan-2-yl)ethanone;decakis(2-methylpropane);2-oxa-6-azaspiro[4.5]decane;2-oxa-9-azaspiro[4.5]decane;2-oxa-5-azaspiro[3.5]nonane;2-oxa-8-azaspiro[3.5]nonane;5-oxa-2-azaspiro[3.4]octane?

2,3,4,6,7,8,9,9a-octahydro-1H-pyrido[1,2-a]pyrazine;2-azaspiro[3.3]heptane;2-azaspiro[3.5]nonane;2-azaspiro[3.4]octane;1-(1-tert-butyl-1,6-diazaspiro[3.3]heptan-6-yl)ethanone;1-tert-butyl-6-methylidene-6λ6-thia-1-azaspiro[3.3]heptane 6-oxide;1-(2,6-diazaspiro[3.3]heptan-2-yl)ethanone;decakis(2-methylpropane);2-oxa-6-azaspiro[4.5]decane;2-oxa-9-azaspiro[4.5]decane;2-oxa-5-azaspiro[3.5]nonane;2-oxa-8-azaspiro[3.5]nonane;5-oxa-2-azaspiro[3.4]octane has a molecular weight of 2242.81 g/mol, XLogP of 24.76, 0 rotatable bonds, 10 hydrogen bond donors, and 21 hydrogen bond acceptors.

Where does this data come from?

All data for 2,3,4,6,7,8,9,9a-octahydro-1H-pyrido[1,2-a]pyrazine;2-azaspiro[3.3]heptane;2-azaspiro[3.5]nonane;2-azaspiro[3.4]octane;1-(1-tert-butyl-1,6-diazaspiro[3.3]heptan-6-yl)ethanone;1-tert-butyl-6-methylidene-6λ6-thia-1-azaspiro[3.3]heptane 6-oxide;1-(2,6-diazaspiro[3.3]heptan-2-yl)ethanone;decakis(2-methylpropane);2-oxa-6-azaspiro[4.5]decane;2-oxa-9-azaspiro[4.5]decane;2-oxa-5-azaspiro[3.5]nonane;2-oxa-8-azaspiro[3.5]nonane;5-oxa-2-azaspiro[3.4]octane is sourced from PubChem (CID 160690656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).