1-tert-butyl-2-(2,2-dimethylpropyl)-2,5-dimethanidylpyrrolidine;1-tert-butyl-2-(2,2-dimethylpropyl)-2-methanidylpiperidin-4-ide;1-tert-butyl-2-(2,2-dimethylpropyl)-6-methanidylpiperidin-3-ide;1-tert-butyl-2-(2,2-dimethylpropyl)-5-methylpiperidin-3-ide;tetrakis(yttrium)

C60H117N4Y4-7 — CID 159215023

About 1-tert-butyl-2-(2,2-dimethylpropyl)-2,5-dimethanidylpyrrolidine;1-tert-butyl-2-(2,2-dimethylpropyl)-2-methanidylpiperidin-4-ide;1-tert-butyl-2-(2,2-dimethylpropyl)-6-methanidylpiperidin-3-ide;1-tert-butyl-2-(2,2-dimethylpropyl)-5-methylpiperidin-3-ide;tetrakis(yttrium)

1-tert-butyl-2-(2,2-dimethylpropyl)-2,5-dimethanidylpyrrolidine;1-tert-butyl-2-(2,2-dimethylpropyl)-2-methanidylpiperidin-4-ide;1-tert-butyl-2-(2,2-dimethylpropyl)-6-methanidylpiperidin-3-ide;1-tert-butyl-2-(2,2-dimethylpropyl)-5-methylpiperidin-3-ide;tetrakis(yttrium) (PubChem CID 159215023) has the molecular formula C60H117N4Y4-7 and a molecular weight of 1250.25 g/mol. Its IUPAC name is 1-tert-butyl-2-(2,2-dimethylpropyl)-2,5-dimethanidylpyrrolidine;1-tert-butyl-2-(2,2-dimethylpropyl)-2-methanidylpiperidin-4-ide;1-tert-butyl-2-(2,2-dimethylpropyl)-6-methanidylpiperidin-3-ide;1-tert-butyl-2-(2,2-dimethylpropyl)-5-methylpiperidin-3-ide;tetrakis(yttrium).

Molecular Properties

• Compound Name: 1-tert-butyl-2-(2,2-dimethylpropyl)-2,5-dimethanidylpyrrolidine;1-tert-butyl-2-(2,2-dimethylpropyl)-2-methanidylpiperidin-4-ide;1-tert-butyl-2-(2,2-dimethylpropyl)-6-methanidylpiperidin-3-ide;1-tert-butyl-2-(2,2-dimethylpropyl)-5-methylpiperidin-3-ide;tetrakis(yttrium)
• PubChem CID: 159215023
• Molecular Formula: C60H117N4Y4-7
• Molecular Weight: 1250.25 g/mol
• Exact Mass: 1249.56
• IUPAC Name: 1-tert-butyl-2-(2,2-dimethylpropyl)-2,5-dimethanidylpyrrolidine;1-tert-butyl-2-(2,2-dimethylpropyl)-2-methanidylpiperidin-4-ide;1-tert-butyl-2-(2,2-dimethylpropyl)-6-methanidylpiperidin-3-ide;1-tert-butyl-2-(2,2-dimethylpropyl)-5-methylpiperidin-3-ide;tetrakis(yttrium)
• SMILES: CC1C[CH-]C(CC(C)(C)C)N(C(C)(C)C)C1.[CH2-]C1(CC(C)(C)C)C[CH-]CCN1C(C)(C)C.[CH2-]C1CCC([CH2-])(CC(C)(C)C)N1C(C)(C)C.[CH2-]C1CC[CH-]C(CC(C)(C)C)N1C(C)(C)C.[Y].[Y].[Y].[Y]
• InChI: InChI=1S/C15H29N.C15H30N.2C15H29N.4Y/c1-12-9-10-15(8,11-13(2,3)4)16(12)14(5,6)7;1-12-8-9-13(10-14(2,3)4)16(11-12)15(5,6)7;1-12-9-8-10-13(11-14(2,3)4)16(12)15(5,6)7;1-13(2,3)12-15(7)10-8-9-11-16(15)14(4,5)6;;;;/h12H,1,8-11H2,2-7H3;9,12-13H,8,10-11H2,1-7H3;10,12-13H,1,8-9,11H2,2-7H3;8H,7,9-12H2,1-6H3;;;;/q-2;-1;2*-2
• InChIKey: VEAUQPSFGXHSFN-UHFFFAOYSA-N
• XLogP: 16.40
• TPSA: 12.96 Ų
• H-Bond Acceptors: 4
• Rotatable Bonds: 4
• Heavy Atoms: 68
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1250.25
LogP ≤ 5	16.40
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	4

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 1-tert-butyl-2-(2,2-dimethylpropyl)-2,5-dimethanidylpyrrolidine;1-tert-butyl-2-(2,2-dimethylpropyl)-2-methanidylpiperidin-4-ide;1-tert-butyl-2-(2,2-dimethylpropyl)-6-methanidylpiperidin-3-ide;1-tert-butyl-2-(2,2-dimethylpropyl)-5-methylpiperidin-3-ide;tetrakis(yttrium)?

The IUPAC name of 1-tert-butyl-2-(2,2-dimethylpropyl)-2,5-dimethanidylpyrrolidine;1-tert-butyl-2-(2,2-dimethylpropyl)-2-methanidylpiperidin-4-ide;1-tert-butyl-2-(2,2-dimethylpropyl)-6-methanidylpiperidin-3-ide;1-tert-butyl-2-(2,2-dimethylpropyl)-5-methylpiperidin-3-ide;tetrakis(yttrium) (CID 159215023) is 1-tert-butyl-2-(2,2-dimethylpropyl)-2,5-dimethanidylpyrrolidine;1-tert-butyl-2-(2,2-dimethylpropyl)-2-methanidylpiperidin-4-ide;1-tert-butyl-2-(2,2-dimethylpropyl)-6-methanidylpiperidin-3-ide;1-tert-butyl-2-(2,2-dimethylpropyl)-5-methylpiperidin-3-ide;tetrakis(yttrium).

What is the SMILES notation for 1-tert-butyl-2-(2,2-dimethylpropyl)-2,5-dimethanidylpyrrolidine;1-tert-butyl-2-(2,2-dimethylpropyl)-2-methanidylpiperidin-4-ide;1-tert-butyl-2-(2,2-dimethylpropyl)-6-methanidylpiperidin-3-ide;1-tert-butyl-2-(2,2-dimethylpropyl)-5-methylpiperidin-3-ide;tetrakis(yttrium)?

The canonical SMILES for 1-tert-butyl-2-(2,2-dimethylpropyl)-2,5-dimethanidylpyrrolidine;1-tert-butyl-2-(2,2-dimethylpropyl)-2-methanidylpiperidin-4-ide;1-tert-butyl-2-(2,2-dimethylpropyl)-6-methanidylpiperidin-3-ide;1-tert-butyl-2-(2,2-dimethylpropyl)-5-methylpiperidin-3-ide;tetrakis(yttrium) is CC1C[CH-]C(CC(C)(C)C)N(C(C)(C)C)C1.[CH2-]C1(CC(C)(C)C)C[CH-]CCN1C(C)(C)C.[CH2-]C1CCC([CH2-])(CC(C)(C)C)N1C(C)(C)C.[CH2-]C1CC[CH-]C(CC(C)(C)C)N1C(C)(C)C.[Y].[Y].[Y].[Y].

What is the InChIKey of 1-tert-butyl-2-(2,2-dimethylpropyl)-2,5-dimethanidylpyrrolidine;1-tert-butyl-2-(2,2-dimethylpropyl)-2-methanidylpiperidin-4-ide;1-tert-butyl-2-(2,2-dimethylpropyl)-6-methanidylpiperidin-3-ide;1-tert-butyl-2-(2,2-dimethylpropyl)-5-methylpiperidin-3-ide;tetrakis(yttrium)?

The InChIKey is VEAUQPSFGXHSFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N.C15H30N.2C15H29N.4Y/c1-12-9-10-15(8,11-13(2,3)4)16(12)14(5,6)7;1-12-8-9-13(10-14(2,3)4)16(11-12)15(5,6)7;1-12-9-8-10-13(11-14(2,3)4)16(12)15(5,6)7;1-13(2,3)12-15(7)10-8-9-11-16(15)14(4,5)6;;;;/h12H,1,8-11H2,2-7H3;9,12-13H,8,10-11H2,1-7H3;10,12-13H,1,8-9,11H2,2-7H3;8H,7,9-12H2,1-6H3;;;;/q-2;-1;2*-2;;;;.

What are the key properties of 1-tert-butyl-2-(2,2-dimethylpropyl)-2,5-dimethanidylpyrrolidine;1-tert-butyl-2-(2,2-dimethylpropyl)-2-methanidylpiperidin-4-ide;1-tert-butyl-2-(2,2-dimethylpropyl)-6-methanidylpiperidin-3-ide;1-tert-butyl-2-(2,2-dimethylpropyl)-5-methylpiperidin-3-ide;tetrakis(yttrium)?

1-tert-butyl-2-(2,2-dimethylpropyl)-2,5-dimethanidylpyrrolidine;1-tert-butyl-2-(2,2-dimethylpropyl)-2-methanidylpiperidin-4-ide;1-tert-butyl-2-(2,2-dimethylpropyl)-6-methanidylpiperidin-3-ide;1-tert-butyl-2-(2,2-dimethylpropyl)-5-methylpiperidin-3-ide;tetrakis(yttrium) has a molecular weight of 1250.25 g/mol, XLogP of 16.40, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 1-tert-butyl-2-(2,2-dimethylpropyl)-2,5-dimethanidylpyrrolidine;1-tert-butyl-2-(2,2-dimethylpropyl)-2-methanidylpiperidin-4-ide;1-tert-butyl-2-(2,2-dimethylpropyl)-6-methanidylpiperidin-3-ide;1-tert-butyl-2-(2,2-dimethylpropyl)-5-methylpiperidin-3-ide;tetrakis(yttrium) is sourced from PubChem (CID 159215023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).