2,6-dimethylheptane;2,5-dimethylhexane;2,6-di(propan-2-yl)-2-azaspiro[3.3]heptane;1,3-di(propan-2-yl)azetidine;tetrakis(1,3-di(propan-2-yl)cyclobutane);bis(1,4-di(propan-2-yl)cyclohexane);1,3-di(propan-2-yl)piperidine;1,4-di(propan-2-yl)piperidine;bis(1,3-di(propan-2-yl)pyrrolidine);bis(2-(2-methylpropyl)-1-propan-2-ylazetidine);(2R)-2-(2-methylpropyl)-1-propan-2-ylazetidine;3-(2-methylpropyl)-1-propan-2-ylazetidine;bis(3-(2-methylpropyl)-1-propan-2-ylpiperidine);4-(2-methylpropyl)-1-propan-2-ylpiperidine;3-(2-methylpropyl)-1-propan-2-ylpyrrolidine

C231H478N14 — CID 158404215

About 2,6-dimethylheptane;2,5-dimethylhexane;2,6-di(propan-2-yl)-2-azaspiro[3.3]heptane;1,3-di(propan-2-yl)azetidine;tetrakis(1,3-di(propan-2-yl)cyclobutane);bis(1,4-di(propan-2-yl)cyclohexane);1,3-di(propan-2-yl)piperidine;1,4-di(propan-2-yl)piperidine;bis(1,3-di(propan-2-yl)pyrrolidine);bis(2-(2-methylpropyl)-1-propan-2-ylazetidine);(2R)-2-(2-methylpropyl)-1-propan-2-ylazetidine;3-(2-methylpropyl)-1-propan-2-ylazetidine;bis(3-(2-methylpropyl)-1-propan-2-ylpiperidine);4-(2-methylpropyl)-1-propan-2-ylpiperidine;3-(2-methylpropyl)-1-propan-2-ylpyrrolidine

2,6-dimethylheptane;2,5-dimethylhexane;2,6-di(propan-2-yl)-2-azaspiro[3.3]heptane;1,3-di(propan-2-yl)azetidine;tetrakis(1,3-di(propan-2-yl)cyclobutane);bis(1,4-di(propan-2-yl)cyclohexane);1,3-di(propan-2-yl)piperidine;1,4-di(propan-2-yl)piperidine;bis(1,3-di(propan-2-yl)pyrrolidine);bis(2-(2-methylpropyl)-1-propan-2-ylazetidine);(2R)-2-(2-methylpropyl)-1-propan-2-ylazetidine;3-(2-methylpropyl)-1-propan-2-ylazetidine;bis(3-(2-methylpropyl)-1-propan-2-ylpiperidine);4-(2-methylpropyl)-1-propan-2-ylpiperidine;3-(2-methylpropyl)-1-propan-2-ylpyrrolidine (PubChem CID 158404215) has the molecular formula C231H478N14 and a molecular weight of 3452.46 g/mol. Its IUPAC name is 2,6-dimethylheptane;2,5-dimethylhexane;2,6-di(propan-2-yl)-2-azaspiro[3.3]heptane;1,3-di(propan-2-yl)azetidine;tetrakis(1,3-di(propan-2-yl)cyclobutane);bis(1,4-di(propan-2-yl)cyclohexane);1,3-di(propan-2-yl)piperidine;1,4-di(propan-2-yl)piperidine;bis(1,3-di(propan-2-yl)pyrrolidine);bis(2-(2-methylpropyl)-1-propan-2-ylazetidine);(2R)-2-(2-methylpropyl)-1-propan-2-ylazetidine;3-(2-methylpropyl)-1-propan-2-ylazetidine;bis(3-(2-methylpropyl)-1-propan-2-ylpiperidine);4-(2-methylpropyl)-1-propan-2-ylpiperidine;3-(2-methylpropyl)-1-propan-2-ylpyrrolidine.

Molecular Properties

• Compound Name: 2,6-dimethylheptane;2,5-dimethylhexane;2,6-di(propan-2-yl)-2-azaspiro[3.3]heptane;1,3-di(propan-2-yl)azetidine;tetrakis(1,3-di(propan-2-yl)cyclobutane);bis(1,4-di(propan-2-yl)cyclohexane);1,3-di(propan-2-yl)piperidine;1,4-di(propan-2-yl)piperidine;bis(1,3-di(propan-2-yl)pyrrolidine);bis(2-(2-methylpropyl)-1-propan-2-ylazetidine);(2R)-2-(2-methylpropyl)-1-propan-2-ylazetidine;3-(2-methylpropyl)-1-propan-2-ylazetidine;bis(3-(2-methylpropyl)-1-propan-2-ylpiperidine);4-(2-methylpropyl)-1-propan-2-ylpiperidine;3-(2-methylpropyl)-1-propan-2-ylpyrrolidine
• PubChem CID: 158404215
• Molecular Formula: C231H478N14
• Molecular Weight: 3452.46 g/mol
• Exact Mass: 3449.78
• IUPAC Name: 2,6-dimethylheptane;2,5-dimethylhexane;2,6-di(propan-2-yl)-2-azaspiro[3.3]heptane;1,3-di(propan-2-yl)azetidine;tetrakis(1,3-di(propan-2-yl)cyclobutane);bis(1,4-di(propan-2-yl)cyclohexane);1,3-di(propan-2-yl)piperidine;1,4-di(propan-2-yl)piperidine;bis(1,3-di(propan-2-yl)pyrrolidine);bis(2-(2-methylpropyl)-1-propan-2-ylazetidine);(2R)-2-(2-methylpropyl)-1-propan-2-ylazetidine;3-(2-methylpropyl)-1-propan-2-ylazetidine;bis(3-(2-methylpropyl)-1-propan-2-ylpiperidine);4-(2-methylpropyl)-1-propan-2-ylpiperidine;3-(2-methylpropyl)-1-propan-2-ylpyrrolidine
• SMILES: CC(C)C1CC(C(C)C)C1.CC(C)C1CC(C(C)C)C1.CC(C)C1CC(C(C)C)C1.CC(C)C1CC(C(C)C)C1.CC(C)C1CC2(C1)CN(C(C)C)C2.CC(C)C1CCC(C(C)C)CC1.CC(C)C1CCC(C(C)C)CC1.CC(C)C1CCCN(C(C)C)C1.CC(C)C1CCN(C(C)C)C1.CC(C)C1CCN(C(C)C)C1.CC(C)C1CCN(C(C)C)CC1.CC(C)C1CN(C(C)C)C1.CC(C)CC1CCCN(C(C)C)C1.CC(C)CC1CCCN(C(C)C)C1.CC(C)CC1CCN(C(C)C)C1.CC(C)CC1CCN(C(C)C)CC1.CC(C)CC1CCN1C(C)C.CC(C)CC1CCN1C(C)C.CC(C)CC1CN(C(C)C)C1.CC(C)CCC(C)C.CC(C)CCCC(C)C.CC(C)C[C@@H]1CCN1C(C)C
• InChI: InChI=1S/C12H23N.3C12H25N.2C12H24.3C11H23N.6C10H21N.4C10H20.C9H19N.C9H20.C8H18/c1-9(2)11-5-12(6-11)7-13(8-12)10(3)4;1-10(2)9-12-5-7-13(8-6-12)11(3)4;2*1-10(2)8-12-6-5-7-13(9-12)11(3)4;3*1-9(2)11-5-7-12(8-6-11)10(3)4;1-9(2)7-11-5-6-12(8-11)10(3)4;1-9(2)11-6-5-7-12(8-11)10(3)4;1-8(2)5-10-6-11(7-10)9(3)4;2*1-8(2)10-5-6-11(7-10)9(3)4;3*1-8(2)7-10-5-6-11(10)9(3)4;5*1-7(2)9-5-10(6-9)8(3)4;1-8(2)6-5-7-9(3)4;1-7(2)5-6-8(3)4/h9-11H,5-8H2,1-4H3;3*10-12H,5-9H2,1-4H3;2*9-12H,5-8H2,1-4H3;3*9-11H,5-8H2,1-4H3;6*8-10H,5-7H2,1-4H3;4*7-10H,5-6H2,1-4H3;7-9H,5-6H2,1-4H3;8-9H,5-7H2,1-4H3;7-8H,5-6H2,1-4H3/t;;;;;;;;;;;;10-;;;;;;;;;/m............0........./s1
• InChIKey: GYMAXCDUONYRTH-BYPJAHDWSA-N
• XLogP: 65.21
• TPSA: 45.36 Ų
• H-Bond Acceptors: 14
• Rotatable Bonds: 55
• Heavy Atoms: 245
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3452.46
LogP ≤ 5	65.21
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	14

Frequently Asked Questions

What is the IUPAC name of 2,6-dimethylheptane;2,5-dimethylhexane;2,6-di(propan-2-yl)-2-azaspiro[3.3]heptane;1,3-di(propan-2-yl)azetidine;tetrakis(1,3-di(propan-2-yl)cyclobutane);bis(1,4-di(propan-2-yl)cyclohexane);1,3-di(propan-2-yl)piperidine;1,4-di(propan-2-yl)piperidine;bis(1,3-di(propan-2-yl)pyrrolidine);bis(2-(2-methylpropyl)-1-propan-2-ylazetidine);(2R)-2-(2-methylpropyl)-1-propan-2-ylazetidine;3-(2-methylpropyl)-1-propan-2-ylazetidine;bis(3-(2-methylpropyl)-1-propan-2-ylpiperidine);4-(2-methylpropyl)-1-propan-2-ylpiperidine;3-(2-methylpropyl)-1-propan-2-ylpyrrolidine?

The IUPAC name of 2,6-dimethylheptane;2,5-dimethylhexane;2,6-di(propan-2-yl)-2-azaspiro[3.3]heptane;1,3-di(propan-2-yl)azetidine;tetrakis(1,3-di(propan-2-yl)cyclobutane);bis(1,4-di(propan-2-yl)cyclohexane);1,3-di(propan-2-yl)piperidine;1,4-di(propan-2-yl)piperidine;bis(1,3-di(propan-2-yl)pyrrolidine);bis(2-(2-methylpropyl)-1-propan-2-ylazetidine);(2R)-2-(2-methylpropyl)-1-propan-2-ylazetidine;3-(2-methylpropyl)-1-propan-2-ylazetidine;bis(3-(2-methylpropyl)-1-propan-2-ylpiperidine);4-(2-methylpropyl)-1-propan-2-ylpiperidine;3-(2-methylpropyl)-1-propan-2-ylpyrrolidine (CID 158404215) is 2,6-dimethylheptane;2,5-dimethylhexane;2,6-di(propan-2-yl)-2-azaspiro[3.3]heptane;1,3-di(propan-2-yl)azetidine;tetrakis(1,3-di(propan-2-yl)cyclobutane);bis(1,4-di(propan-2-yl)cyclohexane);1,3-di(propan-2-yl)piperidine;1,4-di(propan-2-yl)piperidine;bis(1,3-di(propan-2-yl)pyrrolidine);bis(2-(2-methylpropyl)-1-propan-2-ylazetidine);(2R)-2-(2-methylpropyl)-1-propan-2-ylazetidine;3-(2-methylpropyl)-1-propan-2-ylazetidine;bis(3-(2-methylpropyl)-1-propan-2-ylpiperidine);4-(2-methylpropyl)-1-propan-2-ylpiperidine;3-(2-methylpropyl)-1-propan-2-ylpyrrolidine.

What is the SMILES notation for 2,6-dimethylheptane;2,5-dimethylhexane;2,6-di(propan-2-yl)-2-azaspiro[3.3]heptane;1,3-di(propan-2-yl)azetidine;tetrakis(1,3-di(propan-2-yl)cyclobutane);bis(1,4-di(propan-2-yl)cyclohexane);1,3-di(propan-2-yl)piperidine;1,4-di(propan-2-yl)piperidine;bis(1,3-di(propan-2-yl)pyrrolidine);bis(2-(2-methylpropyl)-1-propan-2-ylazetidine);(2R)-2-(2-methylpropyl)-1-propan-2-ylazetidine;3-(2-methylpropyl)-1-propan-2-ylazetidine;bis(3-(2-methylpropyl)-1-propan-2-ylpiperidine);4-(2-methylpropyl)-1-propan-2-ylpiperidine;3-(2-methylpropyl)-1-propan-2-ylpyrrolidine?

The canonical SMILES for 2,6-dimethylheptane;2,5-dimethylhexane;2,6-di(propan-2-yl)-2-azaspiro[3.3]heptane;1,3-di(propan-2-yl)azetidine;tetrakis(1,3-di(propan-2-yl)cyclobutane);bis(1,4-di(propan-2-yl)cyclohexane);1,3-di(propan-2-yl)piperidine;1,4-di(propan-2-yl)piperidine;bis(1,3-di(propan-2-yl)pyrrolidine);bis(2-(2-methylpropyl)-1-propan-2-ylazetidine);(2R)-2-(2-methylpropyl)-1-propan-2-ylazetidine;3-(2-methylpropyl)-1-propan-2-ylazetidine;bis(3-(2-methylpropyl)-1-propan-2-ylpiperidine);4-(2-methylpropyl)-1-propan-2-ylpiperidine;3-(2-methylpropyl)-1-propan-2-ylpyrrolidine is CC(C)C1CC(C(C)C)C1.CC(C)C1CC(C(C)C)C1.CC(C)C1CC(C(C)C)C1.CC(C)C1CC(C(C)C)C1.CC(C)C1CC2(C1)CN(C(C)C)C2.CC(C)C1CCC(C(C)C)CC1.CC(C)C1CCC(C(C)C)CC1.CC(C)C1CCCN(C(C)C)C1.CC(C)C1CCN(C(C)C)C1.CC(C)C1CCN(C(C)C)C1.CC(C)C1CCN(C(C)C)CC1.CC(C)C1CN(C(C)C)C1.CC(C)CC1CCCN(C(C)C)C1.CC(C)CC1CCCN(C(C)C)C1.CC(C)CC1CCN(C(C)C)C1.CC(C)CC1CCN(C(C)C)CC1.CC(C)CC1CCN1C(C)C.CC(C)CC1CCN1C(C)C.CC(C)CC1CN(C(C)C)C1.CC(C)CCC(C)C.CC(C)CCCC(C)C.CC(C)C[C@@H]1CCN1C(C)C.

What is the InChIKey of 2,6-dimethylheptane;2,5-dimethylhexane;2,6-di(propan-2-yl)-2-azaspiro[3.3]heptane;1,3-di(propan-2-yl)azetidine;tetrakis(1,3-di(propan-2-yl)cyclobutane);bis(1,4-di(propan-2-yl)cyclohexane);1,3-di(propan-2-yl)piperidine;1,4-di(propan-2-yl)piperidine;bis(1,3-di(propan-2-yl)pyrrolidine);bis(2-(2-methylpropyl)-1-propan-2-ylazetidine);(2R)-2-(2-methylpropyl)-1-propan-2-ylazetidine;3-(2-methylpropyl)-1-propan-2-ylazetidine;bis(3-(2-methylpropyl)-1-propan-2-ylpiperidine);4-(2-methylpropyl)-1-propan-2-ylpiperidine;3-(2-methylpropyl)-1-propan-2-ylpyrrolidine?

The InChIKey is GYMAXCDUONYRTH-BYPJAHDWSA-N. The full InChI is InChI=1S/C12H23N.3C12H25N.2C12H24.3C11H23N.6C10H21N.4C10H20.C9H19N.C9H20.C8H18/c1-9(2)11-5-12(6-11)7-13(8-12)10(3)4;1-10(2)9-12-5-7-13(8-6-12)11(3)4;2*1-10(2)8-12-6-5-7-13(9-12)11(3)4;3*1-9(2)11-5-7-12(8-6-11)10(3)4;1-9(2)7-11-5-6-12(8-11)10(3)4;1-9(2)11-6-5-7-12(8-11)10(3)4;1-8(2)5-10-6-11(7-10)9(3)4;2*1-8(2)10-5-6-11(7-10)9(3)4;3*1-8(2)7-10-5-6-11(10)9(3)4;5*1-7(2)9-5-10(6-9)8(3)4;1-8(2)6-5-7-9(3)4;1-7(2)5-6-8(3)4/h9-11H,5-8H2,1-4H3;3*10-12H,5-9H2,1-4H3;2*9-12H,5-8H2,1-4H3;3*9-11H,5-8H2,1-4H3;6*8-10H,5-7H2,1-4H3;4*7-10H,5-6H2,1-4H3;7-9H,5-6H2,1-4H3;8-9H,5-7H2,1-4H3;7-8H,5-6H2,1-4H3/t;;;;;;;;;;;;10-;;;;;;;;;/m............0........./s1.

What are the key properties of 2,6-dimethylheptane;2,5-dimethylhexane;2,6-di(propan-2-yl)-2-azaspiro[3.3]heptane;1,3-di(propan-2-yl)azetidine;tetrakis(1,3-di(propan-2-yl)cyclobutane);bis(1,4-di(propan-2-yl)cyclohexane);1,3-di(propan-2-yl)piperidine;1,4-di(propan-2-yl)piperidine;bis(1,3-di(propan-2-yl)pyrrolidine);bis(2-(2-methylpropyl)-1-propan-2-ylazetidine);(2R)-2-(2-methylpropyl)-1-propan-2-ylazetidine;3-(2-methylpropyl)-1-propan-2-ylazetidine;bis(3-(2-methylpropyl)-1-propan-2-ylpiperidine);4-(2-methylpropyl)-1-propan-2-ylpiperidine;3-(2-methylpropyl)-1-propan-2-ylpyrrolidine?

2,6-dimethylheptane;2,5-dimethylhexane;2,6-di(propan-2-yl)-2-azaspiro[3.3]heptane;1,3-di(propan-2-yl)azetidine;tetrakis(1,3-di(propan-2-yl)cyclobutane);bis(1,4-di(propan-2-yl)cyclohexane);1,3-di(propan-2-yl)piperidine;1,4-di(propan-2-yl)piperidine;bis(1,3-di(propan-2-yl)pyrrolidine);bis(2-(2-methylpropyl)-1-propan-2-ylazetidine);(2R)-2-(2-methylpropyl)-1-propan-2-ylazetidine;3-(2-methylpropyl)-1-propan-2-ylazetidine;bis(3-(2-methylpropyl)-1-propan-2-ylpiperidine);4-(2-methylpropyl)-1-propan-2-ylpiperidine;3-(2-methylpropyl)-1-propan-2-ylpyrrolidine has a molecular weight of 3452.46 g/mol, XLogP of 65.21, 55 rotatable bonds, 0 hydrogen bond donors, and 14 hydrogen bond acceptors.

Where does this data come from?

All data for 2,6-dimethylheptane;2,5-dimethylhexane;2,6-di(propan-2-yl)-2-azaspiro[3.3]heptane;1,3-di(propan-2-yl)azetidine;tetrakis(1,3-di(propan-2-yl)cyclobutane);bis(1,4-di(propan-2-yl)cyclohexane);1,3-di(propan-2-yl)piperidine;1,4-di(propan-2-yl)piperidine;bis(1,3-di(propan-2-yl)pyrrolidine);bis(2-(2-methylpropyl)-1-propan-2-ylazetidine);(2R)-2-(2-methylpropyl)-1-propan-2-ylazetidine;3-(2-methylpropyl)-1-propan-2-ylazetidine;bis(3-(2-methylpropyl)-1-propan-2-ylpiperidine);4-(2-methylpropyl)-1-propan-2-ylpiperidine;3-(2-methylpropyl)-1-propan-2-ylpyrrolidine is sourced from PubChem (CID 158404215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).