2-tert-butyl-2-azabicyclo[2.2.1]heptane;8-tert-butyl-8-azaspiro[4.5]decane;1-tert-butyl-4-ethylpiperidine;2-tert-butyl-5-methyl-2,5-diazabicyclo[2.2.1]heptane;1-tert-butyl-N-methylpiperidin-4-amine;1-tert-butyl-4-methylpiperidine;1-tert-butyl-4-propylpiperidine;N-(cyclohexylmethyl)-N,2-dimethylpropan-2-amine;N-(cyclohexylmethyl)-2-methylpropan-2-amine

C99H203N11 — CID 162057527

About 2-tert-butyl-2-azabicyclo[2.2.1]heptane;8-tert-butyl-8-azaspiro[4.5]decane;1-tert-butyl-4-ethylpiperidine;2-tert-butyl-5-methyl-2,5-diazabicyclo[2.2.1]heptane;1-tert-butyl-N-methylpiperidin-4-amine;1-tert-butyl-4-methylpiperidine;1-tert-butyl-4-propylpiperidine;N-(cyclohexylmethyl)-N,2-dimethylpropan-2-amine;N-(cyclohexylmethyl)-2-methylpropan-2-amine

2-tert-butyl-2-azabicyclo[2.2.1]heptane;8-tert-butyl-8-azaspiro[4.5]decane;1-tert-butyl-4-ethylpiperidine;2-tert-butyl-5-methyl-2,5-diazabicyclo[2.2.1]heptane;1-tert-butyl-N-methylpiperidin-4-amine;1-tert-butyl-4-methylpiperidine;1-tert-butyl-4-propylpiperidine;N-(cyclohexylmethyl)-N,2-dimethylpropan-2-amine;N-(cyclohexylmethyl)-2-methylpropan-2-amine (PubChem CID 162057527) has the molecular formula C99H203N11 and a molecular weight of 1547.79 g/mol. Its IUPAC name is 2-tert-butyl-2-azabicyclo[2.2.1]heptane;8-tert-butyl-8-azaspiro[4.5]decane;1-tert-butyl-4-ethylpiperidine;2-tert-butyl-5-methyl-2,5-diazabicyclo[2.2.1]heptane;1-tert-butyl-N-methylpiperidin-4-amine;1-tert-butyl-4-methylpiperidine;1-tert-butyl-4-propylpiperidine;N-(cyclohexylmethyl)-N,2-dimethylpropan-2-amine;N-(cyclohexylmethyl)-2-methylpropan-2-amine.

Molecular Properties

• Compound Name: 2-tert-butyl-2-azabicyclo[2.2.1]heptane;8-tert-butyl-8-azaspiro[4.5]decane;1-tert-butyl-4-ethylpiperidine;2-tert-butyl-5-methyl-2,5-diazabicyclo[2.2.1]heptane;1-tert-butyl-N-methylpiperidin-4-amine;1-tert-butyl-4-methylpiperidine;1-tert-butyl-4-propylpiperidine;N-(cyclohexylmethyl)-N,2-dimethylpropan-2-amine;N-(cyclohexylmethyl)-2-methylpropan-2-amine
• PubChem CID: 162057527
• Molecular Formula: C99H203N11
• Molecular Weight: 1547.79 g/mol
• Exact Mass: 1546.62
• IUPAC Name: 2-tert-butyl-2-azabicyclo[2.2.1]heptane;8-tert-butyl-8-azaspiro[4.5]decane;1-tert-butyl-4-ethylpiperidine;2-tert-butyl-5-methyl-2,5-diazabicyclo[2.2.1]heptane;1-tert-butyl-N-methylpiperidin-4-amine;1-tert-butyl-4-methylpiperidine;1-tert-butyl-4-propylpiperidine;N-(cyclohexylmethyl)-N,2-dimethylpropan-2-amine;N-(cyclohexylmethyl)-2-methylpropan-2-amine
• SMILES: CC(C)(C)N1CC2CCC1C2.CC(C)(C)N1CCC2(CCCC2)CC1.CC(C)(C)NCC1CCCCC1.CC1CCN(C(C)(C)C)CC1.CCC1CCN(C(C)(C)C)CC1.CCCC1CCN(C(C)(C)C)CC1.CN(CC1CCCCC1)C(C)(C)C.CN1CC2CC1CN2C(C)(C)C.CNC1CCN(C(C)(C)C)CC1
• InChI: InChI=1S/C13H25N.2C12H25N.2C11H23N.C10H20N2.C10H22N2.C10H19N.C10H21N/c1-12(2,3)14-10-8-13(9-11-14)6-4-5-7-13;1-12(2,3)13(4)10-11-8-6-5-7-9-11;1-5-6-11-7-9-13(10-8-11)12(2,3)4;1-11(2,3)12-9-10-7-5-4-6-8-10;1-5-10-6-8-12(9-7-10)11(2,3)4;1-10(2,3)12-7-8-5-9(12)6-11(8)4;1-10(2,3)12-7-5-9(11-4)6-8-12;1-10(2,3)11-7-8-4-5-9(11)6-8;1-9-5-7-11(8-6-9)10(2,3)4/h4-11H2,1-3H3;2*11H,5-10H2,1-4H3;10,12H,4-9H2,1-3H3;10H,5-9H2,1-4H3;8-9H,5-7H2,1-4H3;9,11H,5-8H2,1-4H3;8-9H,4-7H2,1-3H3;9H,5-8H2,1-4H3
• InChIKey: YZJQHSRSIMVTOE-UHFFFAOYSA-N
• XLogP: 23.32
• TPSA: 53.22 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 11
• Rotatable Bonds: 8
• Heavy Atoms: 110
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1547.79
LogP ≤ 5	23.32
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	11

Frequently Asked Questions

What is the IUPAC name of 2-tert-butyl-2-azabicyclo[2.2.1]heptane;8-tert-butyl-8-azaspiro[4.5]decane;1-tert-butyl-4-ethylpiperidine;2-tert-butyl-5-methyl-2,5-diazabicyclo[2.2.1]heptane;1-tert-butyl-N-methylpiperidin-4-amine;1-tert-butyl-4-methylpiperidine;1-tert-butyl-4-propylpiperidine;N-(cyclohexylmethyl)-N,2-dimethylpropan-2-amine;N-(cyclohexylmethyl)-2-methylpropan-2-amine?

The IUPAC name of 2-tert-butyl-2-azabicyclo[2.2.1]heptane;8-tert-butyl-8-azaspiro[4.5]decane;1-tert-butyl-4-ethylpiperidine;2-tert-butyl-5-methyl-2,5-diazabicyclo[2.2.1]heptane;1-tert-butyl-N-methylpiperidin-4-amine;1-tert-butyl-4-methylpiperidine;1-tert-butyl-4-propylpiperidine;N-(cyclohexylmethyl)-N,2-dimethylpropan-2-amine;N-(cyclohexylmethyl)-2-methylpropan-2-amine (CID 162057527) is 2-tert-butyl-2-azabicyclo[2.2.1]heptane;8-tert-butyl-8-azaspiro[4.5]decane;1-tert-butyl-4-ethylpiperidine;2-tert-butyl-5-methyl-2,5-diazabicyclo[2.2.1]heptane;1-tert-butyl-N-methylpiperidin-4-amine;1-tert-butyl-4-methylpiperidine;1-tert-butyl-4-propylpiperidine;N-(cyclohexylmethyl)-N,2-dimethylpropan-2-amine;N-(cyclohexylmethyl)-2-methylpropan-2-amine.

What is the SMILES notation for 2-tert-butyl-2-azabicyclo[2.2.1]heptane;8-tert-butyl-8-azaspiro[4.5]decane;1-tert-butyl-4-ethylpiperidine;2-tert-butyl-5-methyl-2,5-diazabicyclo[2.2.1]heptane;1-tert-butyl-N-methylpiperidin-4-amine;1-tert-butyl-4-methylpiperidine;1-tert-butyl-4-propylpiperidine;N-(cyclohexylmethyl)-N,2-dimethylpropan-2-amine;N-(cyclohexylmethyl)-2-methylpropan-2-amine?

The canonical SMILES for 2-tert-butyl-2-azabicyclo[2.2.1]heptane;8-tert-butyl-8-azaspiro[4.5]decane;1-tert-butyl-4-ethylpiperidine;2-tert-butyl-5-methyl-2,5-diazabicyclo[2.2.1]heptane;1-tert-butyl-N-methylpiperidin-4-amine;1-tert-butyl-4-methylpiperidine;1-tert-butyl-4-propylpiperidine;N-(cyclohexylmethyl)-N,2-dimethylpropan-2-amine;N-(cyclohexylmethyl)-2-methylpropan-2-amine is CC(C)(C)N1CC2CCC1C2.CC(C)(C)N1CCC2(CCCC2)CC1.CC(C)(C)NCC1CCCCC1.CC1CCN(C(C)(C)C)CC1.CCC1CCN(C(C)(C)C)CC1.CCCC1CCN(C(C)(C)C)CC1.CN(CC1CCCCC1)C(C)(C)C.CN1CC2CC1CN2C(C)(C)C.CNC1CCN(C(C)(C)C)CC1.

What is the InChIKey of 2-tert-butyl-2-azabicyclo[2.2.1]heptane;8-tert-butyl-8-azaspiro[4.5]decane;1-tert-butyl-4-ethylpiperidine;2-tert-butyl-5-methyl-2,5-diazabicyclo[2.2.1]heptane;1-tert-butyl-N-methylpiperidin-4-amine;1-tert-butyl-4-methylpiperidine;1-tert-butyl-4-propylpiperidine;N-(cyclohexylmethyl)-N,2-dimethylpropan-2-amine;N-(cyclohexylmethyl)-2-methylpropan-2-amine?

The InChIKey is YZJQHSRSIMVTOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N.2C12H25N.2C11H23N.C10H20N2.C10H22N2.C10H19N.C10H21N/c1-12(2,3)14-10-8-13(9-11-14)6-4-5-7-13;1-12(2,3)13(4)10-11-8-6-5-7-9-11;1-5-6-11-7-9-13(10-8-11)12(2,3)4;1-11(2,3)12-9-10-7-5-4-6-8-10;1-5-10-6-8-12(9-7-10)11(2,3)4;1-10(2,3)12-7-8-5-9(12)6-11(8)4;1-10(2,3)12-7-5-9(11-4)6-8-12;1-10(2,3)11-7-8-4-5-9(11)6-8;1-9-5-7-11(8-6-9)10(2,3)4/h4-11H2,1-3H3;2*11H,5-10H2,1-4H3;10,12H,4-9H2,1-3H3;10H,5-9H2,1-4H3;8-9H,5-7H2,1-4H3;9,11H,5-8H2,1-4H3;8-9H,4-7H2,1-3H3;9H,5-8H2,1-4H3.

What are the key properties of 2-tert-butyl-2-azabicyclo[2.2.1]heptane;8-tert-butyl-8-azaspiro[4.5]decane;1-tert-butyl-4-ethylpiperidine;2-tert-butyl-5-methyl-2,5-diazabicyclo[2.2.1]heptane;1-tert-butyl-N-methylpiperidin-4-amine;1-tert-butyl-4-methylpiperidine;1-tert-butyl-4-propylpiperidine;N-(cyclohexylmethyl)-N,2-dimethylpropan-2-amine;N-(cyclohexylmethyl)-2-methylpropan-2-amine?

2-tert-butyl-2-azabicyclo[2.2.1]heptane;8-tert-butyl-8-azaspiro[4.5]decane;1-tert-butyl-4-ethylpiperidine;2-tert-butyl-5-methyl-2,5-diazabicyclo[2.2.1]heptane;1-tert-butyl-N-methylpiperidin-4-amine;1-tert-butyl-4-methylpiperidine;1-tert-butyl-4-propylpiperidine;N-(cyclohexylmethyl)-N,2-dimethylpropan-2-amine;N-(cyclohexylmethyl)-2-methylpropan-2-amine has a molecular weight of 1547.79 g/mol, XLogP of 23.32, 8 rotatable bonds, 2 hydrogen bond donors, and 11 hydrogen bond acceptors.

Where does this data come from?

All data for 2-tert-butyl-2-azabicyclo[2.2.1]heptane;8-tert-butyl-8-azaspiro[4.5]decane;1-tert-butyl-4-ethylpiperidine;2-tert-butyl-5-methyl-2,5-diazabicyclo[2.2.1]heptane;1-tert-butyl-N-methylpiperidin-4-amine;1-tert-butyl-4-methylpiperidine;1-tert-butyl-4-propylpiperidine;N-(cyclohexylmethyl)-N,2-dimethylpropan-2-amine;N-(cyclohexylmethyl)-2-methylpropan-2-amine is sourced from PubChem (CID 162057527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).