1-tert-butyl-3,4-dihydro-2H-pyridine;1-tert-butyl-3,6-dihydro-2H-pyridine;1-tert-butylpiperidine;1-tert-butyl-2H-pyridine;2,5-ditert-butylcyclohexa-1,3-diene;1,4-ditert-butyl-3,4-dihydro-2H-pyridine;1,4-ditert-butyl-3,6-dihydro-2H-pyridine;1,4-ditert-butylpiperidine;tetrakis(2,2-dimethylpropane)

C109H217N7 — CID 159854259

About 1-tert-butyl-3,4-dihydro-2H-pyridine;1-tert-butyl-3,6-dihydro-2H-pyridine;1-tert-butylpiperidine;1-tert-butyl-2H-pyridine;2,5-ditert-butylcyclohexa-1,3-diene;1,4-ditert-butyl-3,4-dihydro-2H-pyridine;1,4-ditert-butyl-3,6-dihydro-2H-pyridine;1,4-ditert-butylpiperidine;tetrakis(2,2-dimethylpropane)

1-tert-butyl-3,4-dihydro-2H-pyridine;1-tert-butyl-3,6-dihydro-2H-pyridine;1-tert-butylpiperidine;1-tert-butyl-2H-pyridine;2,5-ditert-butylcyclohexa-1,3-diene;1,4-ditert-butyl-3,4-dihydro-2H-pyridine;1,4-ditert-butyl-3,6-dihydro-2H-pyridine;1,4-ditert-butylpiperidine;tetrakis(2,2-dimethylpropane) (PubChem CID 159854259) has the molecular formula C109H217N7 and a molecular weight of 1625.98 g/mol. Its IUPAC name is 1-tert-butyl-3,4-dihydro-2H-pyridine;1-tert-butyl-3,6-dihydro-2H-pyridine;1-tert-butylpiperidine;1-tert-butyl-2H-pyridine;2,5-ditert-butylcyclohexa-1,3-diene;1,4-ditert-butyl-3,4-dihydro-2H-pyridine;1,4-ditert-butyl-3,6-dihydro-2H-pyridine;1,4-ditert-butylpiperidine;tetrakis(2,2-dimethylpropane).

Molecular Properties

• Compound Name: 1-tert-butyl-3,4-dihydro-2H-pyridine;1-tert-butyl-3,6-dihydro-2H-pyridine;1-tert-butylpiperidine;1-tert-butyl-2H-pyridine;2,5-ditert-butylcyclohexa-1,3-diene;1,4-ditert-butyl-3,4-dihydro-2H-pyridine;1,4-ditert-butyl-3,6-dihydro-2H-pyridine;1,4-ditert-butylpiperidine;tetrakis(2,2-dimethylpropane)
• PubChem CID: 159854259
• Molecular Formula: C109H217N7
• Molecular Weight: 1625.98 g/mol
• Exact Mass: 1624.72
• IUPAC Name: 1-tert-butyl-3,4-dihydro-2H-pyridine;1-tert-butyl-3,6-dihydro-2H-pyridine;1-tert-butylpiperidine;1-tert-butyl-2H-pyridine;2,5-ditert-butylcyclohexa-1,3-diene;1,4-ditert-butyl-3,4-dihydro-2H-pyridine;1,4-ditert-butyl-3,6-dihydro-2H-pyridine;1,4-ditert-butylpiperidine;tetrakis(2,2-dimethylpropane)
• SMILES: CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C1=CCC(C(C)(C)C)C=C1.CC(C)(C)C1=CCN(C(C)(C)C)CC1.CC(C)(C)C1C=CN(C(C)(C)C)CC1.CC(C)(C)C1CCN(C(C)(C)C)CC1.CC(C)(C)N1C=CC=CC1.CC(C)(C)N1C=CCCC1.CC(C)(C)N1CC=CCC1.CC(C)(C)N1CCCCC1
• InChI: InChI=1S/C14H24.C13H27N.2C13H25N.C9H19N.2C9H17N.C9H15N.4C5H12/c1-13(2,3)11-7-9-12(10-8-11)14(4,5)6;3*1-12(2,3)11-7-9-14(10-8-11)13(4,5)6;4*1-9(2,3)10-7-5-4-6-8-10;4*1-5(2,3)4/h7-9,12H,10H2,1-6H3;11H,7-10H2,1-6H3;7H,8-10H2,1-6H3;7,9,11H,8,10H2,1-6H3;4-8H2,1-3H3;5,7H,4,6,8H2,1-3H3;4-5H,6-8H2,1-3H3;4-7H,8H2,1-3H3;4*1-4H3
• InChIKey: NQIBBZAMGXDNEI-UHFFFAOYSA-N
• XLogP: 32.35
• TPSA: 22.68 Ų
• H-Bond Acceptors: 7
• Heavy Atoms: 116
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1625.98
LogP ≤ 5	32.35
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	7

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 1-tert-butyl-3,4-dihydro-2H-pyridine;1-tert-butyl-3,6-dihydro-2H-pyridine;1-tert-butylpiperidine;1-tert-butyl-2H-pyridine;2,5-ditert-butylcyclohexa-1,3-diene;1,4-ditert-butyl-3,4-dihydro-2H-pyridine;1,4-ditert-butyl-3,6-dihydro-2H-pyridine;1,4-ditert-butylpiperidine;tetrakis(2,2-dimethylpropane)?

The IUPAC name of 1-tert-butyl-3,4-dihydro-2H-pyridine;1-tert-butyl-3,6-dihydro-2H-pyridine;1-tert-butylpiperidine;1-tert-butyl-2H-pyridine;2,5-ditert-butylcyclohexa-1,3-diene;1,4-ditert-butyl-3,4-dihydro-2H-pyridine;1,4-ditert-butyl-3,6-dihydro-2H-pyridine;1,4-ditert-butylpiperidine;tetrakis(2,2-dimethylpropane) (CID 159854259) is 1-tert-butyl-3,4-dihydro-2H-pyridine;1-tert-butyl-3,6-dihydro-2H-pyridine;1-tert-butylpiperidine;1-tert-butyl-2H-pyridine;2,5-ditert-butylcyclohexa-1,3-diene;1,4-ditert-butyl-3,4-dihydro-2H-pyridine;1,4-ditert-butyl-3,6-dihydro-2H-pyridine;1,4-ditert-butylpiperidine;tetrakis(2,2-dimethylpropane).

What is the SMILES notation for 1-tert-butyl-3,4-dihydro-2H-pyridine;1-tert-butyl-3,6-dihydro-2H-pyridine;1-tert-butylpiperidine;1-tert-butyl-2H-pyridine;2,5-ditert-butylcyclohexa-1,3-diene;1,4-ditert-butyl-3,4-dihydro-2H-pyridine;1,4-ditert-butyl-3,6-dihydro-2H-pyridine;1,4-ditert-butylpiperidine;tetrakis(2,2-dimethylpropane)?

The canonical SMILES for 1-tert-butyl-3,4-dihydro-2H-pyridine;1-tert-butyl-3,6-dihydro-2H-pyridine;1-tert-butylpiperidine;1-tert-butyl-2H-pyridine;2,5-ditert-butylcyclohexa-1,3-diene;1,4-ditert-butyl-3,4-dihydro-2H-pyridine;1,4-ditert-butyl-3,6-dihydro-2H-pyridine;1,4-ditert-butylpiperidine;tetrakis(2,2-dimethylpropane) is CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C1=CCC(C(C)(C)C)C=C1.CC(C)(C)C1=CCN(C(C)(C)C)CC1.CC(C)(C)C1C=CN(C(C)(C)C)CC1.CC(C)(C)C1CCN(C(C)(C)C)CC1.CC(C)(C)N1C=CC=CC1.CC(C)(C)N1C=CCCC1.CC(C)(C)N1CC=CCC1.CC(C)(C)N1CCCCC1.

What is the InChIKey of 1-tert-butyl-3,4-dihydro-2H-pyridine;1-tert-butyl-3,6-dihydro-2H-pyridine;1-tert-butylpiperidine;1-tert-butyl-2H-pyridine;2,5-ditert-butylcyclohexa-1,3-diene;1,4-ditert-butyl-3,4-dihydro-2H-pyridine;1,4-ditert-butyl-3,6-dihydro-2H-pyridine;1,4-ditert-butylpiperidine;tetrakis(2,2-dimethylpropane)?

The InChIKey is NQIBBZAMGXDNEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24.C13H27N.2C13H25N.C9H19N.2C9H17N.C9H15N.4C5H12/c1-13(2,3)11-7-9-12(10-8-11)14(4,5)6;3*1-12(2,3)11-7-9-14(10-8-11)13(4,5)6;4*1-9(2,3)10-7-5-4-6-8-10;4*1-5(2,3)4/h7-9,12H,10H2,1-6H3;11H,7-10H2,1-6H3;7H,8-10H2,1-6H3;7,9,11H,8,10H2,1-6H3;4-8H2,1-3H3;5,7H,4,6,8H2,1-3H3;4-5H,6-8H2,1-3H3;4-7H,8H2,1-3H3;4*1-4H3.

What are the key properties of 1-tert-butyl-3,4-dihydro-2H-pyridine;1-tert-butyl-3,6-dihydro-2H-pyridine;1-tert-butylpiperidine;1-tert-butyl-2H-pyridine;2,5-ditert-butylcyclohexa-1,3-diene;1,4-ditert-butyl-3,4-dihydro-2H-pyridine;1,4-ditert-butyl-3,6-dihydro-2H-pyridine;1,4-ditert-butylpiperidine;tetrakis(2,2-dimethylpropane)?

1-tert-butyl-3,4-dihydro-2H-pyridine;1-tert-butyl-3,6-dihydro-2H-pyridine;1-tert-butylpiperidine;1-tert-butyl-2H-pyridine;2,5-ditert-butylcyclohexa-1,3-diene;1,4-ditert-butyl-3,4-dihydro-2H-pyridine;1,4-ditert-butyl-3,6-dihydro-2H-pyridine;1,4-ditert-butylpiperidine;tetrakis(2,2-dimethylpropane) has a molecular weight of 1625.98 g/mol, XLogP of 32.35, 0 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for 1-tert-butyl-3,4-dihydro-2H-pyridine;1-tert-butyl-3,6-dihydro-2H-pyridine;1-tert-butylpiperidine;1-tert-butyl-2H-pyridine;2,5-ditert-butylcyclohexa-1,3-diene;1,4-ditert-butyl-3,4-dihydro-2H-pyridine;1,4-ditert-butyl-3,6-dihydro-2H-pyridine;1,4-ditert-butylpiperidine;tetrakis(2,2-dimethylpropane) is sourced from PubChem (CID 159854259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).