bis(2,2-dimethyl-1-azabicyclo[2.2.1]heptane);bis(7,7-dimethyl-1-azabicyclo[2.2.1]heptane);bis(2,2-dimethyl-1-azabicyclo[3.2.2]nonane);bis(2,2-dimethyl-1-azabicyclo[2.2.2]octane);bis(3,3-dimethyl-1-azabicyclo[2.2.2]octane);bis(1,2,2-trimethylpiperidine);bis(1,3,3-trimethylpiperidine);bis(1,2,2-trimethylpyrrolidine);bis(1,3,3-trimethylpyrrolidine)

C148H294N18 — CID 167628555

About bis(2,2-dimethyl-1-azabicyclo[2.2.1]heptane);bis(7,7-dimethyl-1-azabicyclo[2.2.1]heptane);bis(2,2-dimethyl-1-azabicyclo[3.2.2]nonane);bis(2,2-dimethyl-1-azabicyclo[2.2.2]octane);bis(3,3-dimethyl-1-azabicyclo[2.2.2]octane);bis(1,2,2-trimethylpiperidine);bis(1,3,3-trimethylpiperidine);bis(1,2,2-trimethylpyrrolidine);bis(1,3,3-trimethylpyrrolidine)

bis(2,2-dimethyl-1-azabicyclo[2.2.1]heptane);bis(7,7-dimethyl-1-azabicyclo[2.2.1]heptane);bis(2,2-dimethyl-1-azabicyclo[3.2.2]nonane);bis(2,2-dimethyl-1-azabicyclo[2.2.2]octane);bis(3,3-dimethyl-1-azabicyclo[2.2.2]octane);bis(1,2,2-trimethylpiperidine);bis(1,3,3-trimethylpiperidine);bis(1,2,2-trimethylpyrrolidine);bis(1,3,3-trimethylpyrrolidine) (PubChem CID 167628555) has the molecular formula C148H294N18 and a molecular weight of 2326.11 g/mol. Its IUPAC name is bis(2,2-dimethyl-1-azabicyclo[2.2.1]heptane);bis(7,7-dimethyl-1-azabicyclo[2.2.1]heptane);bis(2,2-dimethyl-1-azabicyclo[3.2.2]nonane);bis(2,2-dimethyl-1-azabicyclo[2.2.2]octane);bis(3,3-dimethyl-1-azabicyclo[2.2.2]octane);bis(1,2,2-trimethylpiperidine);bis(1,3,3-trimethylpiperidine);bis(1,2,2-trimethylpyrrolidine);bis(1,3,3-trimethylpyrrolidine).

Molecular Properties

• Compound Name: bis(2,2-dimethyl-1-azabicyclo[2.2.1]heptane);bis(7,7-dimethyl-1-azabicyclo[2.2.1]heptane);bis(2,2-dimethyl-1-azabicyclo[3.2.2]nonane);bis(2,2-dimethyl-1-azabicyclo[2.2.2]octane);bis(3,3-dimethyl-1-azabicyclo[2.2.2]octane);bis(1,2,2-trimethylpiperidine);bis(1,3,3-trimethylpiperidine);bis(1,2,2-trimethylpyrrolidine);bis(1,3,3-trimethylpyrrolidine)
• PubChem CID: 167628555
• Molecular Formula: C148H294N18
• Molecular Weight: 2326.11 g/mol
• Exact Mass: 2324.36
• IUPAC Name: bis(2,2-dimethyl-1-azabicyclo[2.2.1]heptane);bis(7,7-dimethyl-1-azabicyclo[2.2.1]heptane);bis(2,2-dimethyl-1-azabicyclo[3.2.2]nonane);bis(2,2-dimethyl-1-azabicyclo[2.2.2]octane);bis(3,3-dimethyl-1-azabicyclo[2.2.2]octane);bis(1,2,2-trimethylpiperidine);bis(1,3,3-trimethylpiperidine);bis(1,2,2-trimethylpyrrolidine);bis(1,3,3-trimethylpyrrolidine)
• SMILES: CC1(C)C2CCN1CC2.CC1(C)C2CCN1CC2.CC1(C)CC2CCN1C2.CC1(C)CC2CCN1C2.CC1(C)CC2CCN1CC2.CC1(C)CC2CCN1CC2.CC1(C)CCC2CCN1CC2.CC1(C)CCC2CCN1CC2.CC1(C)CN2CCC1CC2.CC1(C)CN2CCC1CC2.CN1CCC(C)(C)C1.CN1CCC(C)(C)C1.CN1CCCC(C)(C)C1.CN1CCCC(C)(C)C1.CN1CCCC1(C)C.CN1CCCC1(C)C.CN1CCCCC1(C)C.CN1CCCCC1(C)C
• InChI: InChI=1S/2C10H19N.4C9H17N.4C8H15N.4C8H17N.4C7H15N/c2*1-10(2)6-3-9-4-7-11(10)8-5-9;2*1-9(2)7-10-5-3-8(9)4-6-10;2*1-9(2)7-8-3-5-10(9)6-4-8;2*1-8(2)7-3-5-9(8)6-4-7;2*1-8(2)5-7-3-4-9(8)6-7;2*1-8(2)5-4-6-9(3)7-8;2*1-8(2)6-4-5-7-9(8)3;2*1-7(2)4-5-8(3)6-7;2*1-7(2)5-4-6-8(7)3/h2*9H,3-8H2,1-2H3;4*8H,3-7H2,1-2H3;4*7H,3-6H2,1-2H3;4*4-7H2,1-3H3;4*4-6H2,1-3H3
• InChIKey: NLMYLCJPDFVLLN-UHFFFAOYSA-N
• XLogP: 30.66
• TPSA: 58.32 Ų
• H-Bond Acceptors: 18
• Heavy Atoms: 166
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2326.11
LogP ≤ 5	30.66
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	18

Frequently Asked Questions

What is the IUPAC name of bis(2,2-dimethyl-1-azabicyclo[2.2.1]heptane);bis(7,7-dimethyl-1-azabicyclo[2.2.1]heptane);bis(2,2-dimethyl-1-azabicyclo[3.2.2]nonane);bis(2,2-dimethyl-1-azabicyclo[2.2.2]octane);bis(3,3-dimethyl-1-azabicyclo[2.2.2]octane);bis(1,2,2-trimethylpiperidine);bis(1,3,3-trimethylpiperidine);bis(1,2,2-trimethylpyrrolidine);bis(1,3,3-trimethylpyrrolidine)?

The IUPAC name of bis(2,2-dimethyl-1-azabicyclo[2.2.1]heptane);bis(7,7-dimethyl-1-azabicyclo[2.2.1]heptane);bis(2,2-dimethyl-1-azabicyclo[3.2.2]nonane);bis(2,2-dimethyl-1-azabicyclo[2.2.2]octane);bis(3,3-dimethyl-1-azabicyclo[2.2.2]octane);bis(1,2,2-trimethylpiperidine);bis(1,3,3-trimethylpiperidine);bis(1,2,2-trimethylpyrrolidine);bis(1,3,3-trimethylpyrrolidine) (CID 167628555) is bis(2,2-dimethyl-1-azabicyclo[2.2.1]heptane);bis(7,7-dimethyl-1-azabicyclo[2.2.1]heptane);bis(2,2-dimethyl-1-azabicyclo[3.2.2]nonane);bis(2,2-dimethyl-1-azabicyclo[2.2.2]octane);bis(3,3-dimethyl-1-azabicyclo[2.2.2]octane);bis(1,2,2-trimethylpiperidine);bis(1,3,3-trimethylpiperidine);bis(1,2,2-trimethylpyrrolidine);bis(1,3,3-trimethylpyrrolidine).

What is the SMILES notation for bis(2,2-dimethyl-1-azabicyclo[2.2.1]heptane);bis(7,7-dimethyl-1-azabicyclo[2.2.1]heptane);bis(2,2-dimethyl-1-azabicyclo[3.2.2]nonane);bis(2,2-dimethyl-1-azabicyclo[2.2.2]octane);bis(3,3-dimethyl-1-azabicyclo[2.2.2]octane);bis(1,2,2-trimethylpiperidine);bis(1,3,3-trimethylpiperidine);bis(1,2,2-trimethylpyrrolidine);bis(1,3,3-trimethylpyrrolidine)?

The canonical SMILES for bis(2,2-dimethyl-1-azabicyclo[2.2.1]heptane);bis(7,7-dimethyl-1-azabicyclo[2.2.1]heptane);bis(2,2-dimethyl-1-azabicyclo[3.2.2]nonane);bis(2,2-dimethyl-1-azabicyclo[2.2.2]octane);bis(3,3-dimethyl-1-azabicyclo[2.2.2]octane);bis(1,2,2-trimethylpiperidine);bis(1,3,3-trimethylpiperidine);bis(1,2,2-trimethylpyrrolidine);bis(1,3,3-trimethylpyrrolidine) is CC1(C)C2CCN1CC2.CC1(C)C2CCN1CC2.CC1(C)CC2CCN1C2.CC1(C)CC2CCN1C2.CC1(C)CC2CCN1CC2.CC1(C)CC2CCN1CC2.CC1(C)CCC2CCN1CC2.CC1(C)CCC2CCN1CC2.CC1(C)CN2CCC1CC2.CC1(C)CN2CCC1CC2.CN1CCC(C)(C)C1.CN1CCC(C)(C)C1.CN1CCCC(C)(C)C1.CN1CCCC(C)(C)C1.CN1CCCC1(C)C.CN1CCCC1(C)C.CN1CCCCC1(C)C.CN1CCCCC1(C)C.

What is the InChIKey of bis(2,2-dimethyl-1-azabicyclo[2.2.1]heptane);bis(7,7-dimethyl-1-azabicyclo[2.2.1]heptane);bis(2,2-dimethyl-1-azabicyclo[3.2.2]nonane);bis(2,2-dimethyl-1-azabicyclo[2.2.2]octane);bis(3,3-dimethyl-1-azabicyclo[2.2.2]octane);bis(1,2,2-trimethylpiperidine);bis(1,3,3-trimethylpiperidine);bis(1,2,2-trimethylpyrrolidine);bis(1,3,3-trimethylpyrrolidine)?

The InChIKey is NLMYLCJPDFVLLN-UHFFFAOYSA-N. The full InChI is InChI=1S/2C10H19N.4C9H17N.4C8H15N.4C8H17N.4C7H15N/c2*1-10(2)6-3-9-4-7-11(10)8-5-9;2*1-9(2)7-10-5-3-8(9)4-6-10;2*1-9(2)7-8-3-5-10(9)6-4-8;2*1-8(2)7-3-5-9(8)6-4-7;2*1-8(2)5-7-3-4-9(8)6-7;2*1-8(2)5-4-6-9(3)7-8;2*1-8(2)6-4-5-7-9(8)3;2*1-7(2)4-5-8(3)6-7;2*1-7(2)5-4-6-8(7)3/h2*9H,3-8H2,1-2H3;4*8H,3-7H2,1-2H3;4*7H,3-6H2,1-2H3;4*4-7H2,1-3H3;4*4-6H2,1-3H3.

What are the key properties of bis(2,2-dimethyl-1-azabicyclo[2.2.1]heptane);bis(7,7-dimethyl-1-azabicyclo[2.2.1]heptane);bis(2,2-dimethyl-1-azabicyclo[3.2.2]nonane);bis(2,2-dimethyl-1-azabicyclo[2.2.2]octane);bis(3,3-dimethyl-1-azabicyclo[2.2.2]octane);bis(1,2,2-trimethylpiperidine);bis(1,3,3-trimethylpiperidine);bis(1,2,2-trimethylpyrrolidine);bis(1,3,3-trimethylpyrrolidine)?

bis(2,2-dimethyl-1-azabicyclo[2.2.1]heptane);bis(7,7-dimethyl-1-azabicyclo[2.2.1]heptane);bis(2,2-dimethyl-1-azabicyclo[3.2.2]nonane);bis(2,2-dimethyl-1-azabicyclo[2.2.2]octane);bis(3,3-dimethyl-1-azabicyclo[2.2.2]octane);bis(1,2,2-trimethylpiperidine);bis(1,3,3-trimethylpiperidine);bis(1,2,2-trimethylpyrrolidine);bis(1,3,3-trimethylpyrrolidine) has a molecular weight of 2326.11 g/mol, XLogP of 30.66, 0 rotatable bonds, 0 hydrogen bond donors, and 18 hydrogen bond acceptors.

Where does this data come from?

All data for bis(2,2-dimethyl-1-azabicyclo[2.2.1]heptane);bis(7,7-dimethyl-1-azabicyclo[2.2.1]heptane);bis(2,2-dimethyl-1-azabicyclo[3.2.2]nonane);bis(2,2-dimethyl-1-azabicyclo[2.2.2]octane);bis(3,3-dimethyl-1-azabicyclo[2.2.2]octane);bis(1,2,2-trimethylpiperidine);bis(1,3,3-trimethylpiperidine);bis(1,2,2-trimethylpyrrolidine);bis(1,3,3-trimethylpyrrolidine) is sourced from PubChem (CID 167628555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).