2-methyl-1,2,3,5,6,7,8,8a-octahydroindolizine;7-methyl-1,2,3,5,6,7,8,8a-octahydroindolizine;2-methyl-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizine;2-methyl-2,3,5,6,7,8-hexahydro-1H-pyrrolizine

C36H68N4 — CID 158888597

About 2-methyl-1,2,3,5,6,7,8,8a-octahydroindolizine;7-methyl-1,2,3,5,6,7,8,8a-octahydroindolizine;2-methyl-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizine;2-methyl-2,3,5,6,7,8-hexahydro-1H-pyrrolizine

2-methyl-1,2,3,5,6,7,8,8a-octahydroindolizine;7-methyl-1,2,3,5,6,7,8,8a-octahydroindolizine;2-methyl-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizine;2-methyl-2,3,5,6,7,8-hexahydro-1H-pyrrolizine (PubChem CID 158888597) has the molecular formula C36H68N4 and a molecular weight of 556.97 g/mol. Its IUPAC name is 2-methyl-1,2,3,5,6,7,8,8a-octahydroindolizine;7-methyl-1,2,3,5,6,7,8,8a-octahydroindolizine;2-methyl-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizine;2-methyl-2,3,5,6,7,8-hexahydro-1H-pyrrolizine.

Molecular Properties

• Compound Name: 2-methyl-1,2,3,5,6,7,8,8a-octahydroindolizine;7-methyl-1,2,3,5,6,7,8,8a-octahydroindolizine;2-methyl-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizine;2-methyl-2,3,5,6,7,8-hexahydro-1H-pyrrolizine
• PubChem CID: 158888597
• Molecular Formula: C36H68N4
• Molecular Weight: 556.97 g/mol
• Exact Mass: 556.54
• IUPAC Name: 2-methyl-1,2,3,5,6,7,8,8a-octahydroindolizine;7-methyl-1,2,3,5,6,7,8,8a-octahydroindolizine;2-methyl-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizine;2-methyl-2,3,5,6,7,8-hexahydro-1H-pyrrolizine
• SMILES: CC1CC2CCCCN2C1.CC1CC2CCCN2C1.CC1CCN2CCCC2C1.CC1CCN2CCCCC2C1
• InChI: InChI=1S/C10H19N.2C9H17N.C8H15N/c1-9-5-7-11-6-3-2-4-10(11)8-9;1-8-4-6-10-5-2-3-9(10)7-8;1-8-6-9-4-2-3-5-10(9)7-8;1-7-5-8-3-2-4-9(8)6-7/h9-10H,2-8H2,1H3;2*8-9H,2-7H2,1H3;7-8H,2-6H2,1H3
• InChIKey: JDXZJCRSTVJRBZ-UHFFFAOYSA-N
• XLogP: 7.52
• TPSA: 12.96 Ų
• H-Bond Acceptors: 4
• Heavy Atoms: 40
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	556.97
LogP ≤ 5	7.52
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1,2,3,5,6,7,8,8a-octahydroindolizine;7-methyl-1,2,3,5,6,7,8,8a-octahydroindolizine;2-methyl-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizine;2-methyl-2,3,5,6,7,8-hexahydro-1H-pyrrolizine?

The IUPAC name of 2-methyl-1,2,3,5,6,7,8,8a-octahydroindolizine;7-methyl-1,2,3,5,6,7,8,8a-octahydroindolizine;2-methyl-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizine;2-methyl-2,3,5,6,7,8-hexahydro-1H-pyrrolizine (CID 158888597) is 2-methyl-1,2,3,5,6,7,8,8a-octahydroindolizine;7-methyl-1,2,3,5,6,7,8,8a-octahydroindolizine;2-methyl-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizine;2-methyl-2,3,5,6,7,8-hexahydro-1H-pyrrolizine.

What is the SMILES notation for 2-methyl-1,2,3,5,6,7,8,8a-octahydroindolizine;7-methyl-1,2,3,5,6,7,8,8a-octahydroindolizine;2-methyl-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizine;2-methyl-2,3,5,6,7,8-hexahydro-1H-pyrrolizine?

The canonical SMILES for 2-methyl-1,2,3,5,6,7,8,8a-octahydroindolizine;7-methyl-1,2,3,5,6,7,8,8a-octahydroindolizine;2-methyl-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizine;2-methyl-2,3,5,6,7,8-hexahydro-1H-pyrrolizine is CC1CC2CCCCN2C1.CC1CC2CCCN2C1.CC1CCN2CCCC2C1.CC1CCN2CCCCC2C1.

What is the InChIKey of 2-methyl-1,2,3,5,6,7,8,8a-octahydroindolizine;7-methyl-1,2,3,5,6,7,8,8a-octahydroindolizine;2-methyl-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizine;2-methyl-2,3,5,6,7,8-hexahydro-1H-pyrrolizine?

The InChIKey is JDXZJCRSTVJRBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N.2C9H17N.C8H15N/c1-9-5-7-11-6-3-2-4-10(11)8-9;1-8-4-6-10-5-2-3-9(10)7-8;1-8-6-9-4-2-3-5-10(9)7-8;1-7-5-8-3-2-4-9(8)6-7/h9-10H,2-8H2,1H3;2*8-9H,2-7H2,1H3;7-8H,2-6H2,1H3.

What are the key properties of 2-methyl-1,2,3,5,6,7,8,8a-octahydroindolizine;7-methyl-1,2,3,5,6,7,8,8a-octahydroindolizine;2-methyl-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizine;2-methyl-2,3,5,6,7,8-hexahydro-1H-pyrrolizine?

2-methyl-1,2,3,5,6,7,8,8a-octahydroindolizine;7-methyl-1,2,3,5,6,7,8,8a-octahydroindolizine;2-methyl-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizine;2-methyl-2,3,5,6,7,8-hexahydro-1H-pyrrolizine has a molecular weight of 556.97 g/mol, XLogP of 7.52, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 2-methyl-1,2,3,5,6,7,8,8a-octahydroindolizine;7-methyl-1,2,3,5,6,7,8,8a-octahydroindolizine;2-methyl-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizine;2-methyl-2,3,5,6,7,8-hexahydro-1H-pyrrolizine is sourced from PubChem (CID 158888597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).