tert-butylcyclobutane;tert-butylcyclohexane;bis(1-tert-butyl-4-methylpiperazine);2,2-dimethylpropane;ethane;methane;1-methylpiperidine;2-methylpropane;pentane;yttrium(3+)

C61H138N5Y — CID 158133550

About tert-butylcyclobutane;tert-butylcyclohexane;bis(1-tert-butyl-4-methylpiperazine);2,2-dimethylpropane;ethane;methane;1-methylpiperidine;2-methylpropane;pentane;yttrium(3+)

tert-butylcyclobutane;tert-butylcyclohexane;bis(1-tert-butyl-4-methylpiperazine);2,2-dimethylpropane;ethane;methane;1-methylpiperidine;2-methylpropane;pentane;yttrium(3+) (PubChem CID 158133550) has the molecular formula C61H138N5Y and a molecular weight of 1030.72 g/mol. Its IUPAC name is tert-butylcyclobutane;tert-butylcyclohexane;bis(1-tert-butyl-4-methylpiperazine);2,2-dimethylpropane;ethane;methane;1-methylpiperidine;2-methylpropane;pentane;yttrium(3+).

Molecular Properties

• Compound Name: tert-butylcyclobutane;tert-butylcyclohexane;bis(1-tert-butyl-4-methylpiperazine);2,2-dimethylpropane;ethane;methane;1-methylpiperidine;2-methylpropane;pentane;yttrium(3+)
• PubChem CID: 158133550
• Molecular Formula: C61H138N5Y
• Molecular Weight: 1030.72 g/mol
• Exact Mass: 1030.00
• IUPAC Name: tert-butylcyclobutane;tert-butylcyclohexane;bis(1-tert-butyl-4-methylpiperazine);2,2-dimethylpropane;ethane;methane;1-methylpiperidine;2-methylpropane;pentane;yttrium(3+)
• SMILES: C.C.C.CC.CC(C)(C)C.CC(C)(C)C1CCC1.CC(C)(C)C1CCCCC1.CN1CCCCC1.CN1CCN(C(C)(C)C)CC1.CN1CCN(C(C)(C)C)CC1.C[C-](C)C.[CH2-]CCC[CH2-].[Y+3]
• InChI: InChI=1S/C10H20.2C9H20N2.C8H16.C6H13N.C5H12.C5H10.C4H9.C2H6.3CH4.Y/c1-10(2,3)9-7-5-4-6-8-9;2*1-9(2,3)11-7-5-10(4)6-8-11;1-8(2,3)7-5-4-6-7;1-7-5-3-2-4-6-7;1-5(2,3)4;1-3-5-4-2;1-4(2)3;1-2;;;;/h9H,4-8H2,1-3H3;2*5-8H2,1-4H3;7H,4-6H2,1-3H3;2-6H2,1H3;1-4H3;1-5H2;1-3H3;1-2H3;3*1H4;/q;;;;;;-2;-1;;;;;+3
• InChIKey: FTBLUEJUBUNWMO-UHFFFAOYSA-N
• XLogP: 18.04
• TPSA: 16.20 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 2
• Heavy Atoms: 67
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1030.72
LogP ≤ 5	18.04
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	5

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of tert-butylcyclobutane;tert-butylcyclohexane;bis(1-tert-butyl-4-methylpiperazine);2,2-dimethylpropane;ethane;methane;1-methylpiperidine;2-methylpropane;pentane;yttrium(3+)?

The IUPAC name of tert-butylcyclobutane;tert-butylcyclohexane;bis(1-tert-butyl-4-methylpiperazine);2,2-dimethylpropane;ethane;methane;1-methylpiperidine;2-methylpropane;pentane;yttrium(3+) (CID 158133550) is tert-butylcyclobutane;tert-butylcyclohexane;bis(1-tert-butyl-4-methylpiperazine);2,2-dimethylpropane;ethane;methane;1-methylpiperidine;2-methylpropane;pentane;yttrium(3+).

What is the SMILES notation for tert-butylcyclobutane;tert-butylcyclohexane;bis(1-tert-butyl-4-methylpiperazine);2,2-dimethylpropane;ethane;methane;1-methylpiperidine;2-methylpropane;pentane;yttrium(3+)?

The canonical SMILES for tert-butylcyclobutane;tert-butylcyclohexane;bis(1-tert-butyl-4-methylpiperazine);2,2-dimethylpropane;ethane;methane;1-methylpiperidine;2-methylpropane;pentane;yttrium(3+) is C.C.C.CC.CC(C)(C)C.CC(C)(C)C1CCC1.CC(C)(C)C1CCCCC1.CN1CCCCC1.CN1CCN(C(C)(C)C)CC1.CN1CCN(C(C)(C)C)CC1.C[C-](C)C.[CH2-]CCC[CH2-].[Y+3].

What is the InChIKey of tert-butylcyclobutane;tert-butylcyclohexane;bis(1-tert-butyl-4-methylpiperazine);2,2-dimethylpropane;ethane;methane;1-methylpiperidine;2-methylpropane;pentane;yttrium(3+)?

The InChIKey is FTBLUEJUBUNWMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20.2C9H20N2.C8H16.C6H13N.C5H12.C5H10.C4H9.C2H6.3CH4.Y/c1-10(2,3)9-7-5-4-6-8-9;2*1-9(2,3)11-7-5-10(4)6-8-11;1-8(2,3)7-5-4-6-7;1-7-5-3-2-4-6-7;1-5(2,3)4;1-3-5-4-2;1-4(2)3;1-2;;;;/h9H,4-8H2,1-3H3;2*5-8H2,1-4H3;7H,4-6H2,1-3H3;2-6H2,1H3;1-4H3;1-5H2;1-3H3;1-2H3;3*1H4;/q;;;;;;-2;-1;;;;;+3.

What are the key properties of tert-butylcyclobutane;tert-butylcyclohexane;bis(1-tert-butyl-4-methylpiperazine);2,2-dimethylpropane;ethane;methane;1-methylpiperidine;2-methylpropane;pentane;yttrium(3+)?

tert-butylcyclobutane;tert-butylcyclohexane;bis(1-tert-butyl-4-methylpiperazine);2,2-dimethylpropane;ethane;methane;1-methylpiperidine;2-methylpropane;pentane;yttrium(3+) has a molecular weight of 1030.72 g/mol, XLogP of 18.04, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for tert-butylcyclobutane;tert-butylcyclohexane;bis(1-tert-butyl-4-methylpiperazine);2,2-dimethylpropane;ethane;methane;1-methylpiperidine;2-methylpropane;pentane;yttrium(3+) is sourced from PubChem (CID 158133550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).