N-tert-butyl-3-[(2-tert-butyl-4-pyridinyl)oxy]cyclobutan-1-amine;1-tert-butyl-4-(4-tert-butyl-2-pyridinyl)piperazine;1-tert-butyl-4-[2-(3,3-dimethylbutoxy)ethyl]piperazine;N-tert-butyl-3-[2-[(2-methylpropan-2-yl)oxy]ethoxy]cyclobutan-1-amine;N-tert-butyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-amine;N-tert-butyl-3-[[5-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]oxy]cyclobutan-1-amine;1-(4-tert-butylpiperazin-1-yl)-6,6-dimethylheptan-1-one;(4-tert-butylpiperazin-1-yl)-[3-(2,2-dimethylpropyl)phenyl]methanone

C133H246N16O9 — CID 157428563

About N-tert-butyl-3-[(2-tert-butyl-4-pyridinyl)oxy]cyclobutan-1-amine;1-tert-butyl-4-(4-tert-butyl-2-pyridinyl)piperazine;1-tert-butyl-4-[2-(3,3-dimethylbutoxy)ethyl]piperazine;N-tert-butyl-3-[2-[(2-methylpropan-2-yl)oxy]ethoxy]cyclobutan-1-amine;N-tert-butyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-amine;N-tert-butyl-3-[[5-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]oxy]cyclobutan-1-amine;1-(4-tert-butylpiperazin-1-yl)-6,6-dimethylheptan-1-one;(4-tert-butylpiperazin-1-yl)-[3-(2,2-dimethylpropyl)phenyl]methanone

N-tert-butyl-3-[(2-tert-butyl-4-pyridinyl)oxy]cyclobutan-1-amine;1-tert-butyl-4-(4-tert-butyl-2-pyridinyl)piperazine;1-tert-butyl-4-[2-(3,3-dimethylbutoxy)ethyl]piperazine;N-tert-butyl-3-[2-[(2-methylpropan-2-yl)oxy]ethoxy]cyclobutan-1-amine;N-tert-butyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-amine;N-tert-butyl-3-[[5-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]oxy]cyclobutan-1-amine;1-(4-tert-butylpiperazin-1-yl)-6,6-dimethylheptan-1-one;(4-tert-butylpiperazin-1-yl)-[3-(2,2-dimethylpropyl)phenyl]methanone (PubChem CID 157428563) has the molecular formula C133H246N16O9 and a molecular weight of 2213.53 g/mol. Its IUPAC name is N-tert-butyl-3-[(2-tert-butyl-4-pyridinyl)oxy]cyclobutan-1-amine;1-tert-butyl-4-(4-tert-butyl-2-pyridinyl)piperazine;1-tert-butyl-4-[2-(3,3-dimethylbutoxy)ethyl]piperazine;N-tert-butyl-3-[2-[(2-methylpropan-2-yl)oxy]ethoxy]cyclobutan-1-amine;N-tert-butyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-amine;N-tert-butyl-3-[[5-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]oxy]cyclobutan-1-amine;1-(4-tert-butylpiperazin-1-yl)-6,6-dimethylheptan-1-one;(4-tert-butylpiperazin-1-yl)-[3-(2,2-dimethylpropyl)phenyl]methanone.

Molecular Properties

• Compound Name: N-tert-butyl-3-[(2-tert-butyl-4-pyridinyl)oxy]cyclobutan-1-amine;1-tert-butyl-4-(4-tert-butyl-2-pyridinyl)piperazine;1-tert-butyl-4-[2-(3,3-dimethylbutoxy)ethyl]piperazine;N-tert-butyl-3-[2-[(2-methylpropan-2-yl)oxy]ethoxy]cyclobutan-1-amine;N-tert-butyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-amine;N-tert-butyl-3-[[5-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]oxy]cyclobutan-1-amine;1-(4-tert-butylpiperazin-1-yl)-6,6-dimethylheptan-1-one;(4-tert-butylpiperazin-1-yl)-[3-(2,2-dimethylpropyl)phenyl]methanone
• PubChem CID: 157428563
• Molecular Formula: C133H246N16O9
• Molecular Weight: 2213.53 g/mol
• Exact Mass: 2211.93
• IUPAC Name: N-tert-butyl-3-[(2-tert-butyl-4-pyridinyl)oxy]cyclobutan-1-amine;1-tert-butyl-4-(4-tert-butyl-2-pyridinyl)piperazine;1-tert-butyl-4-[2-(3,3-dimethylbutoxy)ethyl]piperazine;N-tert-butyl-3-[2-[(2-methylpropan-2-yl)oxy]ethoxy]cyclobutan-1-amine;N-tert-butyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-amine;N-tert-butyl-3-[[5-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]oxy]cyclobutan-1-amine;1-(4-tert-butylpiperazin-1-yl)-6,6-dimethylheptan-1-one;(4-tert-butylpiperazin-1-yl)-[3-(2,2-dimethylpropyl)phenyl]methanone
• SMILES: CC(C)(C)CCCCC(=O)N1CCN(C(C)(C)C)CC1.CC(C)(C)CCOCCN1CCN(C(C)(C)C)CC1.CC(C)(C)Cc1cccc(C(=O)N2CCN(C(C)(C)C)CC2)c1.CC(C)(C)NC1CC(OCCOC(C)(C)C)C1.CC(C)(C)NC1CC(Oc2ccc(OC(C)(C)C)cn2)C1.CC(C)(C)NC1CC(Oc2ccnc(C(C)(C)C)c2)C1.CC(C)(C)NC1CCN(CCOC(C)(C)C)CC1.CC(C)(C)c1ccnc(N2CCN(C(C)(C)C)CC2)c1
• InChI: InChI=1S/C20H32N2O.C17H29N3.C17H28N2O2.C17H28N2O.C17H34N2O.C16H34N2O.C15H32N2O.C14H29NO2/c1-19(2,3)15-16-8-7-9-17(14-16)18(23)21-10-12-22(13-11-21)20(4,5)6;1-16(2,3)14-7-8-18-15(13-14)19-9-11-20(12-10-19)17(4,5)6;1-16(2,3)19-12-9-14(10-12)20-15-8-7-13(11-18-15)21-17(4,5)6;1-16(2,3)15-11-13(7-8-18-15)20-14-9-12(10-14)19-17(4,5)6;1-16(2,3)10-8-7-9-15(20)18-11-13-19(14-12-18)17(4,5)6;1-15(2,3)7-13-19-14-12-17-8-10-18(11-9-17)16(4,5)6;1-14(2,3)16-13-7-9-17(10-8-13)11-12-18-15(4,5)6;1-13(2,3)15-11-9-12(10-11)16-7-8-17-14(4,5)6/h7-9,14H,10-13,15H2,1-6H3;7-8,13H,9-12H2,1-6H3;7-8,11-12,14,19H,9-10H2,1-6H3;7-8,11-12,14,19H,9-10H2,1-6H3;7-14H2,1-6H3;7-14H2,1-6H3;13,16H,7-12H2,1-6H3;11-12,15H,7-10H2,1-6H3
• InChIKey: BQGFZKNWBFFFPY-UHFFFAOYSA-N
• XLogP: 26.15
• TPSA: 214.70 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 23
• Rotatable Bonds: 28
• Heavy Atoms: 158
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2213.53
LogP ≤ 5	26.15
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	23

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-3-[(2-tert-butyl-4-pyridinyl)oxy]cyclobutan-1-amine;1-tert-butyl-4-(4-tert-butyl-2-pyridinyl)piperazine;1-tert-butyl-4-[2-(3,3-dimethylbutoxy)ethyl]piperazine;N-tert-butyl-3-[2-[(2-methylpropan-2-yl)oxy]ethoxy]cyclobutan-1-amine;N-tert-butyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-amine;N-tert-butyl-3-[[5-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]oxy]cyclobutan-1-amine;1-(4-tert-butylpiperazin-1-yl)-6,6-dimethylheptan-1-one;(4-tert-butylpiperazin-1-yl)-[3-(2,2-dimethylpropyl)phenyl]methanone?

The IUPAC name of N-tert-butyl-3-[(2-tert-butyl-4-pyridinyl)oxy]cyclobutan-1-amine;1-tert-butyl-4-(4-tert-butyl-2-pyridinyl)piperazine;1-tert-butyl-4-[2-(3,3-dimethylbutoxy)ethyl]piperazine;N-tert-butyl-3-[2-[(2-methylpropan-2-yl)oxy]ethoxy]cyclobutan-1-amine;N-tert-butyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-amine;N-tert-butyl-3-[[5-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]oxy]cyclobutan-1-amine;1-(4-tert-butylpiperazin-1-yl)-6,6-dimethylheptan-1-one;(4-tert-butylpiperazin-1-yl)-[3-(2,2-dimethylpropyl)phenyl]methanone (CID 157428563) is N-tert-butyl-3-[(2-tert-butyl-4-pyridinyl)oxy]cyclobutan-1-amine;1-tert-butyl-4-(4-tert-butyl-2-pyridinyl)piperazine;1-tert-butyl-4-[2-(3,3-dimethylbutoxy)ethyl]piperazine;N-tert-butyl-3-[2-[(2-methylpropan-2-yl)oxy]ethoxy]cyclobutan-1-amine;N-tert-butyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-amine;N-tert-butyl-3-[[5-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]oxy]cyclobutan-1-amine;1-(4-tert-butylpiperazin-1-yl)-6,6-dimethylheptan-1-one;(4-tert-butylpiperazin-1-yl)-[3-(2,2-dimethylpropyl)phenyl]methanone.

What is the SMILES notation for N-tert-butyl-3-[(2-tert-butyl-4-pyridinyl)oxy]cyclobutan-1-amine;1-tert-butyl-4-(4-tert-butyl-2-pyridinyl)piperazine;1-tert-butyl-4-[2-(3,3-dimethylbutoxy)ethyl]piperazine;N-tert-butyl-3-[2-[(2-methylpropan-2-yl)oxy]ethoxy]cyclobutan-1-amine;N-tert-butyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-amine;N-tert-butyl-3-[[5-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]oxy]cyclobutan-1-amine;1-(4-tert-butylpiperazin-1-yl)-6,6-dimethylheptan-1-one;(4-tert-butylpiperazin-1-yl)-[3-(2,2-dimethylpropyl)phenyl]methanone?

The canonical SMILES for N-tert-butyl-3-[(2-tert-butyl-4-pyridinyl)oxy]cyclobutan-1-amine;1-tert-butyl-4-(4-tert-butyl-2-pyridinyl)piperazine;1-tert-butyl-4-[2-(3,3-dimethylbutoxy)ethyl]piperazine;N-tert-butyl-3-[2-[(2-methylpropan-2-yl)oxy]ethoxy]cyclobutan-1-amine;N-tert-butyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-amine;N-tert-butyl-3-[[5-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]oxy]cyclobutan-1-amine;1-(4-tert-butylpiperazin-1-yl)-6,6-dimethylheptan-1-one;(4-tert-butylpiperazin-1-yl)-[3-(2,2-dimethylpropyl)phenyl]methanone is CC(C)(C)CCCCC(=O)N1CCN(C(C)(C)C)CC1.CC(C)(C)CCOCCN1CCN(C(C)(C)C)CC1.CC(C)(C)Cc1cccc(C(=O)N2CCN(C(C)(C)C)CC2)c1.CC(C)(C)NC1CC(OCCOC(C)(C)C)C1.CC(C)(C)NC1CC(Oc2ccc(OC(C)(C)C)cn2)C1.CC(C)(C)NC1CC(Oc2ccnc(C(C)(C)C)c2)C1.CC(C)(C)NC1CCN(CCOC(C)(C)C)CC1.CC(C)(C)c1ccnc(N2CCN(C(C)(C)C)CC2)c1.

What is the InChIKey of N-tert-butyl-3-[(2-tert-butyl-4-pyridinyl)oxy]cyclobutan-1-amine;1-tert-butyl-4-(4-tert-butyl-2-pyridinyl)piperazine;1-tert-butyl-4-[2-(3,3-dimethylbutoxy)ethyl]piperazine;N-tert-butyl-3-[2-[(2-methylpropan-2-yl)oxy]ethoxy]cyclobutan-1-amine;N-tert-butyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-amine;N-tert-butyl-3-[[5-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]oxy]cyclobutan-1-amine;1-(4-tert-butylpiperazin-1-yl)-6,6-dimethylheptan-1-one;(4-tert-butylpiperazin-1-yl)-[3-(2,2-dimethylpropyl)phenyl]methanone?

The InChIKey is BQGFZKNWBFFFPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H32N2O.C17H29N3.C17H28N2O2.C17H28N2O.C17H34N2O.C16H34N2O.C15H32N2O.C14H29NO2/c1-19(2,3)15-16-8-7-9-17(14-16)18(23)21-10-12-22(13-11-21)20(4,5)6;1-16(2,3)14-7-8-18-15(13-14)19-9-11-20(12-10-19)17(4,5)6;1-16(2,3)19-12-9-14(10-12)20-15-8-7-13(11-18-15)21-17(4,5)6;1-16(2,3)15-11-13(7-8-18-15)20-14-9-12(10-14)19-17(4,5)6;1-16(2,3)10-8-7-9-15(20)18-11-13-19(14-12-18)17(4,5)6;1-15(2,3)7-13-19-14-12-17-8-10-18(11-9-17)16(4,5)6;1-14(2,3)16-13-7-9-17(10-8-13)11-12-18-15(4,5)6;1-13(2,3)15-11-9-12(10-11)16-7-8-17-14(4,5)6/h7-9,14H,10-13,15H2,1-6H3;7-8,13H,9-12H2,1-6H3;7-8,11-12,14,19H,9-10H2,1-6H3;7-8,11-12,14,19H,9-10H2,1-6H3;7-14H2,1-6H3;7-14H2,1-6H3;13,16H,7-12H2,1-6H3;11-12,15H,7-10H2,1-6H3.

What are the key properties of N-tert-butyl-3-[(2-tert-butyl-4-pyridinyl)oxy]cyclobutan-1-amine;1-tert-butyl-4-(4-tert-butyl-2-pyridinyl)piperazine;1-tert-butyl-4-[2-(3,3-dimethylbutoxy)ethyl]piperazine;N-tert-butyl-3-[2-[(2-methylpropan-2-yl)oxy]ethoxy]cyclobutan-1-amine;N-tert-butyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-amine;N-tert-butyl-3-[[5-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]oxy]cyclobutan-1-amine;1-(4-tert-butylpiperazin-1-yl)-6,6-dimethylheptan-1-one;(4-tert-butylpiperazin-1-yl)-[3-(2,2-dimethylpropyl)phenyl]methanone?

N-tert-butyl-3-[(2-tert-butyl-4-pyridinyl)oxy]cyclobutan-1-amine;1-tert-butyl-4-(4-tert-butyl-2-pyridinyl)piperazine;1-tert-butyl-4-[2-(3,3-dimethylbutoxy)ethyl]piperazine;N-tert-butyl-3-[2-[(2-methylpropan-2-yl)oxy]ethoxy]cyclobutan-1-amine;N-tert-butyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-amine;N-tert-butyl-3-[[5-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]oxy]cyclobutan-1-amine;1-(4-tert-butylpiperazin-1-yl)-6,6-dimethylheptan-1-one;(4-tert-butylpiperazin-1-yl)-[3-(2,2-dimethylpropyl)phenyl]methanone has a molecular weight of 2213.53 g/mol, XLogP of 26.15, 28 rotatable bonds, 4 hydrogen bond donors, and 23 hydrogen bond acceptors.

Where does this data come from?

All data for N-tert-butyl-3-[(2-tert-butyl-4-pyridinyl)oxy]cyclobutan-1-amine;1-tert-butyl-4-(4-tert-butyl-2-pyridinyl)piperazine;1-tert-butyl-4-[2-(3,3-dimethylbutoxy)ethyl]piperazine;N-tert-butyl-3-[2-[(2-methylpropan-2-yl)oxy]ethoxy]cyclobutan-1-amine;N-tert-butyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-amine;N-tert-butyl-3-[[5-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]oxy]cyclobutan-1-amine;1-(4-tert-butylpiperazin-1-yl)-6,6-dimethylheptan-1-one;(4-tert-butylpiperazin-1-yl)-[3-(2,2-dimethylpropyl)phenyl]methanone is sourced from PubChem (CID 157428563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).