1-tert-butyl-3,4-dihydro-2H-pyridine;1-tert-butyl-3,6-dihydro-2H-pyridine;1-tert-butylpiperidine;1-tert-butyl-2H-pyridine;1,4-ditert-butyl-3,4-dihydro-2H-pyridine;1,4-ditert-butyl-3,6-dihydro-2H-pyridine;1,4-ditert-butylpiperidine;1,4-ditert-butyl-2H-pyridine;tris(2,2-dimethylpropane);2-methylpropane

C107H214N8 — CID 161296930

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;1,4-ditert-butyl-3,4-dihydro-2H-pyridine;1,4-ditert-butyl-3,6-dihydro-2H-pyridine;1,4-ditert-butylpiperidine;1,4-ditert-butyl-2H-pyridine;tris(2,2-dimethylpropane);2-methylpropane

1-tert-butyl-3,4-dihydro-2H-pyridine;1-tert-butyl-3,6-dihydro-2H-pyridine;1-tert-butylpiperidine;1-tert-butyl-2H-pyridine;1,4-ditert-butyl-3,4-dihydro-2H-pyridine;1,4-ditert-butyl-3,6-dihydro-2H-pyridine;1,4-ditert-butylpiperidine;1,4-ditert-butyl-2H-pyridine;tris(2,2-dimethylpropane);2-methylpropane (PubChem CID 161296930) has the molecular formula C107H214N8 and a molecular weight of 1612.94 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;1,4-ditert-butyl-3,4-dihydro-2H-pyridine;1,4-ditert-butyl-3,6-dihydro-2H-pyridine;1,4-ditert-butylpiperidine;1,4-ditert-butyl-2H-pyridine;tris(2,2-dimethylpropane);2-methylpropane.

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;1,4-ditert-butyl-3,4-dihydro-2H-pyridine;1,4-ditert-butyl-3,6-dihydro-2H-pyridine;1,4-ditert-butylpiperidine;1,4-ditert-butyl-2H-pyridine;tris(2,2-dimethylpropane);2-methylpropane
• PubChem CID: 161296930
• Molecular Formula: C107H214N8
• Molecular Weight: 1612.94 g/mol
• Exact Mass: 1611.70
• 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;1,4-ditert-butyl-3,4-dihydro-2H-pyridine;1,4-ditert-butyl-3,6-dihydro-2H-pyridine;1,4-ditert-butylpiperidine;1,4-ditert-butyl-2H-pyridine;tris(2,2-dimethylpropane);2-methylpropane
• SMILES: CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C1=CCN(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.CC(C)C
• InChI: InChI=1S/C13H27N.2C13H25N.C13H23N.C9H19N.2C9H17N.C9H15N.3C5H12.C4H10/c4*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;3*1-5(2,3)4;1-4(2)3/h11H,7-10H2,1-6H3;7H,8-10H2,1-6H3;7,9,11H,8,10H2,1-6H3;7-9H,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;3*1-4H3;4H,1-3H3
• InChIKey: VHCDHPNNOQIPAY-UHFFFAOYSA-N
• XLogP: 30.96
• TPSA: 25.92 Ų
• H-Bond Acceptors: 8
• Heavy Atoms: 115
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1612.94
LogP ≤ 5	30.96
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	8

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;1,4-ditert-butyl-3,4-dihydro-2H-pyridine;1,4-ditert-butyl-3,6-dihydro-2H-pyridine;1,4-ditert-butylpiperidine;1,4-ditert-butyl-2H-pyridine;tris(2,2-dimethylpropane);2-methylpropane?

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;1,4-ditert-butyl-3,4-dihydro-2H-pyridine;1,4-ditert-butyl-3,6-dihydro-2H-pyridine;1,4-ditert-butylpiperidine;1,4-ditert-butyl-2H-pyridine;tris(2,2-dimethylpropane);2-methylpropane (CID 161296930) 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;1,4-ditert-butyl-3,4-dihydro-2H-pyridine;1,4-ditert-butyl-3,6-dihydro-2H-pyridine;1,4-ditert-butylpiperidine;1,4-ditert-butyl-2H-pyridine;tris(2,2-dimethylpropane);2-methylpropane.

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;1,4-ditert-butyl-3,4-dihydro-2H-pyridine;1,4-ditert-butyl-3,6-dihydro-2H-pyridine;1,4-ditert-butylpiperidine;1,4-ditert-butyl-2H-pyridine;tris(2,2-dimethylpropane);2-methylpropane?

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;1,4-ditert-butyl-3,4-dihydro-2H-pyridine;1,4-ditert-butyl-3,6-dihydro-2H-pyridine;1,4-ditert-butylpiperidine;1,4-ditert-butyl-2H-pyridine;tris(2,2-dimethylpropane);2-methylpropane is CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C1=CCN(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.CC(C)C.

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;1,4-ditert-butyl-3,4-dihydro-2H-pyridine;1,4-ditert-butyl-3,6-dihydro-2H-pyridine;1,4-ditert-butylpiperidine;1,4-ditert-butyl-2H-pyridine;tris(2,2-dimethylpropane);2-methylpropane?

The InChIKey is VHCDHPNNOQIPAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N.2C13H25N.C13H23N.C9H19N.2C9H17N.C9H15N.3C5H12.C4H10/c4*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;3*1-5(2,3)4;1-4(2)3/h11H,7-10H2,1-6H3;7H,8-10H2,1-6H3;7,9,11H,8,10H2,1-6H3;7-9H,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;3*1-4H3;4H,1-3H3.

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;1,4-ditert-butyl-3,4-dihydro-2H-pyridine;1,4-ditert-butyl-3,6-dihydro-2H-pyridine;1,4-ditert-butylpiperidine;1,4-ditert-butyl-2H-pyridine;tris(2,2-dimethylpropane);2-methylpropane?

1-tert-butyl-3,4-dihydro-2H-pyridine;1-tert-butyl-3,6-dihydro-2H-pyridine;1-tert-butylpiperidine;1-tert-butyl-2H-pyridine;1,4-ditert-butyl-3,4-dihydro-2H-pyridine;1,4-ditert-butyl-3,6-dihydro-2H-pyridine;1,4-ditert-butylpiperidine;1,4-ditert-butyl-2H-pyridine;tris(2,2-dimethylpropane);2-methylpropane has a molecular weight of 1612.94 g/mol, XLogP of 30.96, 0 rotatable bonds, 0 hydrogen bond donors, and 8 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;1,4-ditert-butyl-3,4-dihydro-2H-pyridine;1,4-ditert-butyl-3,6-dihydro-2H-pyridine;1,4-ditert-butylpiperidine;1,4-ditert-butyl-2H-pyridine;tris(2,2-dimethylpropane);2-methylpropane is sourced from PubChem (CID 161296930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).