1-bromo-3,3-dimethylbutane;bis(tert-butylcyclohexane);4-tert-butyl-1-methylpiperidine;4-tert-butylpiperidine;3,3-dimethylbutan-1-amine;2-(3,3-dimethylbutoxy)ethanamine;1-(3,3-dimethylbutyl)-4-methylpiperazine;4-(3,3-dimethylbutyl)morpholine;1-(3,3-dimethylbutyl)piperazine;tris(1-(3,3-dimethylbutyl)piperidine);6,6-dimethylheptan-1-amine;4,4-dimethylpentan-1-amine;bis(2,2-dimethylpentane);4,4-dimethylpentane-1,2-diol;1-fluoro-3,3-dimethylbutane;N,N,3,3-tetramethylbutan-1-amine

C174H381BrFN15O4 — CID 158205262

About 1-bromo-3,3-dimethylbutane;bis(tert-butylcyclohexane);4-tert-butyl-1-methylpiperidine;4-tert-butylpiperidine;3,3-dimethylbutan-1-amine;2-(3,3-dimethylbutoxy)ethanamine;1-(3,3-dimethylbutyl)-4-methylpiperazine;4-(3,3-dimethylbutyl)morpholine;1-(3,3-dimethylbutyl)piperazine;tris(1-(3,3-dimethylbutyl)piperidine);6,6-dimethylheptan-1-amine;4,4-dimethylpentan-1-amine;bis(2,2-dimethylpentane);4,4-dimethylpentane-1,2-diol;1-fluoro-3,3-dimethylbutane;N,N,3,3-tetramethylbutan-1-amine

1-bromo-3,3-dimethylbutane;bis(tert-butylcyclohexane);4-tert-butyl-1-methylpiperidine;4-tert-butylpiperidine;3,3-dimethylbutan-1-amine;2-(3,3-dimethylbutoxy)ethanamine;1-(3,3-dimethylbutyl)-4-methylpiperazine;4-(3,3-dimethylbutyl)morpholine;1-(3,3-dimethylbutyl)piperazine;tris(1-(3,3-dimethylbutyl)piperidine);6,6-dimethylheptan-1-amine;4,4-dimethylpentan-1-amine;bis(2,2-dimethylpentane);4,4-dimethylpentane-1,2-diol;1-fluoro-3,3-dimethylbutane;N,N,3,3-tetramethylbutan-1-amine (PubChem CID 158205262) has the molecular formula C174H381BrFN15O4 and a molecular weight of 2846.96 g/mol. Its IUPAC name is 1-bromo-3,3-dimethylbutane;bis(tert-butylcyclohexane);4-tert-butyl-1-methylpiperidine;4-tert-butylpiperidine;3,3-dimethylbutan-1-amine;2-(3,3-dimethylbutoxy)ethanamine;1-(3,3-dimethylbutyl)-4-methylpiperazine;4-(3,3-dimethylbutyl)morpholine;1-(3,3-dimethylbutyl)piperazine;tris(1-(3,3-dimethylbutyl)piperidine);6,6-dimethylheptan-1-amine;4,4-dimethylpentan-1-amine;bis(2,2-dimethylpentane);4,4-dimethylpentane-1,2-diol;1-fluoro-3,3-dimethylbutane;N,N,3,3-tetramethylbutan-1-amine.

Molecular Properties

• Compound Name: 1-bromo-3,3-dimethylbutane;bis(tert-butylcyclohexane);4-tert-butyl-1-methylpiperidine;4-tert-butylpiperidine;3,3-dimethylbutan-1-amine;2-(3,3-dimethylbutoxy)ethanamine;1-(3,3-dimethylbutyl)-4-methylpiperazine;4-(3,3-dimethylbutyl)morpholine;1-(3,3-dimethylbutyl)piperazine;tris(1-(3,3-dimethylbutyl)piperidine);6,6-dimethylheptan-1-amine;4,4-dimethylpentan-1-amine;bis(2,2-dimethylpentane);4,4-dimethylpentane-1,2-diol;1-fluoro-3,3-dimethylbutane;N,N,3,3-tetramethylbutan-1-amine
• PubChem CID: 158205262
• Molecular Formula: C174H381BrFN15O4
• Molecular Weight: 2846.96 g/mol
• Exact Mass: 2843.92
• IUPAC Name: 1-bromo-3,3-dimethylbutane;bis(tert-butylcyclohexane);4-tert-butyl-1-methylpiperidine;4-tert-butylpiperidine;3,3-dimethylbutan-1-amine;2-(3,3-dimethylbutoxy)ethanamine;1-(3,3-dimethylbutyl)-4-methylpiperazine;4-(3,3-dimethylbutyl)morpholine;1-(3,3-dimethylbutyl)piperazine;tris(1-(3,3-dimethylbutyl)piperidine);6,6-dimethylheptan-1-amine;4,4-dimethylpentan-1-amine;bis(2,2-dimethylpentane);4,4-dimethylpentane-1,2-diol;1-fluoro-3,3-dimethylbutane;N,N,3,3-tetramethylbutan-1-amine
• SMILES: CC(C)(C)C1CCCCC1.CC(C)(C)C1CCCCC1.CC(C)(C)C1CCNCC1.CC(C)(C)CC(O)CO.CC(C)(C)CCBr.CC(C)(C)CCCCCN.CC(C)(C)CCCN.CC(C)(C)CCF.CC(C)(C)CCN.CC(C)(C)CCN1CCCCC1.CC(C)(C)CCN1CCCCC1.CC(C)(C)CCN1CCCCC1.CC(C)(C)CCN1CCNCC1.CC(C)(C)CCN1CCOCC1.CC(C)(C)CCOCCN.CCCC(C)(C)C.CCCC(C)(C)C.CN(C)CCC(C)(C)C.CN1CCC(C(C)(C)C)CC1.CN1CCN(CCC(C)(C)C)CC1
• InChI: InChI=1S/C11H24N2.3C11H23N.C10H22N2.C10H21NO.C10H21N.2C10H20.C9H19N.C9H21N.C8H19NO.C8H19N.C7H17N.C7H16O2.2C7H16.C6H13Br.C6H13F.C6H15N/c1-11(2,3)5-6-13-9-7-12(4)8-10-13;3*1-11(2,3)7-10-12-8-5-4-6-9-12;1-10(2,3)4-7-12-8-5-11-6-9-12;1-10(2,3)4-5-11-6-8-12-9-7-11;1-10(2,3)9-5-7-11(4)8-6-9;2*1-10(2,3)9-7-5-4-6-8-9;1-9(2,3)8-4-6-10-7-5-8;1-9(2,3)7-5-4-6-8-10;1-8(2,3)4-6-10-7-5-9;1-8(2,3)6-7-9(4)5;1-7(2,3)5-4-6-8;1-7(2,3)4-6(9)5-8;2*1-5-6-7(2,3)4;3*1-6(2,3)4-5-7/h5-10H2,1-4H3;3*4-10H2,1-3H3;11H,4-9H2,1-3H3;4-9H2,1-3H3;9H,5-8H2,1-4H3;2*9H,4-8H2,1-3H3;8,10H,4-7H2,1-3H3;4-8,10H2,1-3H3;4-7,9H2,1-3H3;6-7H2,1-5H3;4-6,8H2,1-3H3;6,8-9H,4-5H2,1-3H3;2*5-6H2,1-4H3;2*4-5H2,1-3H3;4-5,7H2,1-3H3
• InChIKey: GBKNUWZNMBKVPJ-UHFFFAOYSA-N
• XLogP: 45.85
• TPSA: 216.22 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 19
• Rotatable Bonds: 31
• Heavy Atoms: 195
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2846.96
LogP ≤ 5	45.85
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	19

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 1-bromo-3,3-dimethylbutane;bis(tert-butylcyclohexane);4-tert-butyl-1-methylpiperidine;4-tert-butylpiperidine;3,3-dimethylbutan-1-amine;2-(3,3-dimethylbutoxy)ethanamine;1-(3,3-dimethylbutyl)-4-methylpiperazine;4-(3,3-dimethylbutyl)morpholine;1-(3,3-dimethylbutyl)piperazine;tris(1-(3,3-dimethylbutyl)piperidine);6,6-dimethylheptan-1-amine;4,4-dimethylpentan-1-amine;bis(2,2-dimethylpentane);4,4-dimethylpentane-1,2-diol;1-fluoro-3,3-dimethylbutane;N,N,3,3-tetramethylbutan-1-amine?

The IUPAC name of 1-bromo-3,3-dimethylbutane;bis(tert-butylcyclohexane);4-tert-butyl-1-methylpiperidine;4-tert-butylpiperidine;3,3-dimethylbutan-1-amine;2-(3,3-dimethylbutoxy)ethanamine;1-(3,3-dimethylbutyl)-4-methylpiperazine;4-(3,3-dimethylbutyl)morpholine;1-(3,3-dimethylbutyl)piperazine;tris(1-(3,3-dimethylbutyl)piperidine);6,6-dimethylheptan-1-amine;4,4-dimethylpentan-1-amine;bis(2,2-dimethylpentane);4,4-dimethylpentane-1,2-diol;1-fluoro-3,3-dimethylbutane;N,N,3,3-tetramethylbutan-1-amine (CID 158205262) is 1-bromo-3,3-dimethylbutane;bis(tert-butylcyclohexane);4-tert-butyl-1-methylpiperidine;4-tert-butylpiperidine;3,3-dimethylbutan-1-amine;2-(3,3-dimethylbutoxy)ethanamine;1-(3,3-dimethylbutyl)-4-methylpiperazine;4-(3,3-dimethylbutyl)morpholine;1-(3,3-dimethylbutyl)piperazine;tris(1-(3,3-dimethylbutyl)piperidine);6,6-dimethylheptan-1-amine;4,4-dimethylpentan-1-amine;bis(2,2-dimethylpentane);4,4-dimethylpentane-1,2-diol;1-fluoro-3,3-dimethylbutane;N,N,3,3-tetramethylbutan-1-amine.

What is the SMILES notation for 1-bromo-3,3-dimethylbutane;bis(tert-butylcyclohexane);4-tert-butyl-1-methylpiperidine;4-tert-butylpiperidine;3,3-dimethylbutan-1-amine;2-(3,3-dimethylbutoxy)ethanamine;1-(3,3-dimethylbutyl)-4-methylpiperazine;4-(3,3-dimethylbutyl)morpholine;1-(3,3-dimethylbutyl)piperazine;tris(1-(3,3-dimethylbutyl)piperidine);6,6-dimethylheptan-1-amine;4,4-dimethylpentan-1-amine;bis(2,2-dimethylpentane);4,4-dimethylpentane-1,2-diol;1-fluoro-3,3-dimethylbutane;N,N,3,3-tetramethylbutan-1-amine?

The canonical SMILES for 1-bromo-3,3-dimethylbutane;bis(tert-butylcyclohexane);4-tert-butyl-1-methylpiperidine;4-tert-butylpiperidine;3,3-dimethylbutan-1-amine;2-(3,3-dimethylbutoxy)ethanamine;1-(3,3-dimethylbutyl)-4-methylpiperazine;4-(3,3-dimethylbutyl)morpholine;1-(3,3-dimethylbutyl)piperazine;tris(1-(3,3-dimethylbutyl)piperidine);6,6-dimethylheptan-1-amine;4,4-dimethylpentan-1-amine;bis(2,2-dimethylpentane);4,4-dimethylpentane-1,2-diol;1-fluoro-3,3-dimethylbutane;N,N,3,3-tetramethylbutan-1-amine is CC(C)(C)C1CCCCC1.CC(C)(C)C1CCCCC1.CC(C)(C)C1CCNCC1.CC(C)(C)CC(O)CO.CC(C)(C)CCBr.CC(C)(C)CCCCCN.CC(C)(C)CCCN.CC(C)(C)CCF.CC(C)(C)CCN.CC(C)(C)CCN1CCCCC1.CC(C)(C)CCN1CCCCC1.CC(C)(C)CCN1CCCCC1.CC(C)(C)CCN1CCNCC1.CC(C)(C)CCN1CCOCC1.CC(C)(C)CCOCCN.CCCC(C)(C)C.CCCC(C)(C)C.CN(C)CCC(C)(C)C.CN1CCC(C(C)(C)C)CC1.CN1CCN(CCC(C)(C)C)CC1.

What is the InChIKey of 1-bromo-3,3-dimethylbutane;bis(tert-butylcyclohexane);4-tert-butyl-1-methylpiperidine;4-tert-butylpiperidine;3,3-dimethylbutan-1-amine;2-(3,3-dimethylbutoxy)ethanamine;1-(3,3-dimethylbutyl)-4-methylpiperazine;4-(3,3-dimethylbutyl)morpholine;1-(3,3-dimethylbutyl)piperazine;tris(1-(3,3-dimethylbutyl)piperidine);6,6-dimethylheptan-1-amine;4,4-dimethylpentan-1-amine;bis(2,2-dimethylpentane);4,4-dimethylpentane-1,2-diol;1-fluoro-3,3-dimethylbutane;N,N,3,3-tetramethylbutan-1-amine?

The InChIKey is GBKNUWZNMBKVPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2.3C11H23N.C10H22N2.C10H21NO.C10H21N.2C10H20.C9H19N.C9H21N.C8H19NO.C8H19N.C7H17N.C7H16O2.2C7H16.C6H13Br.C6H13F.C6H15N/c1-11(2,3)5-6-13-9-7-12(4)8-10-13;3*1-11(2,3)7-10-12-8-5-4-6-9-12;1-10(2,3)4-7-12-8-5-11-6-9-12;1-10(2,3)4-5-11-6-8-12-9-7-11;1-10(2,3)9-5-7-11(4)8-6-9;2*1-10(2,3)9-7-5-4-6-8-9;1-9(2,3)8-4-6-10-7-5-8;1-9(2,3)7-5-4-6-8-10;1-8(2,3)4-6-10-7-5-9;1-8(2,3)6-7-9(4)5;1-7(2,3)5-4-6-8;1-7(2,3)4-6(9)5-8;2*1-5-6-7(2,3)4;3*1-6(2,3)4-5-7/h5-10H2,1-4H3;3*4-10H2,1-3H3;11H,4-9H2,1-3H3;4-9H2,1-3H3;9H,5-8H2,1-4H3;2*9H,4-8H2,1-3H3;8,10H,4-7H2,1-3H3;4-8,10H2,1-3H3;4-7,9H2,1-3H3;6-7H2,1-5H3;4-6,8H2,1-3H3;6,8-9H,4-5H2,1-3H3;2*5-6H2,1-4H3;2*4-5H2,1-3H3;4-5,7H2,1-3H3.

What are the key properties of 1-bromo-3,3-dimethylbutane;bis(tert-butylcyclohexane);4-tert-butyl-1-methylpiperidine;4-tert-butylpiperidine;3,3-dimethylbutan-1-amine;2-(3,3-dimethylbutoxy)ethanamine;1-(3,3-dimethylbutyl)-4-methylpiperazine;4-(3,3-dimethylbutyl)morpholine;1-(3,3-dimethylbutyl)piperazine;tris(1-(3,3-dimethylbutyl)piperidine);6,6-dimethylheptan-1-amine;4,4-dimethylpentan-1-amine;bis(2,2-dimethylpentane);4,4-dimethylpentane-1,2-diol;1-fluoro-3,3-dimethylbutane;N,N,3,3-tetramethylbutan-1-amine?

1-bromo-3,3-dimethylbutane;bis(tert-butylcyclohexane);4-tert-butyl-1-methylpiperidine;4-tert-butylpiperidine;3,3-dimethylbutan-1-amine;2-(3,3-dimethylbutoxy)ethanamine;1-(3,3-dimethylbutyl)-4-methylpiperazine;4-(3,3-dimethylbutyl)morpholine;1-(3,3-dimethylbutyl)piperazine;tris(1-(3,3-dimethylbutyl)piperidine);6,6-dimethylheptan-1-amine;4,4-dimethylpentan-1-amine;bis(2,2-dimethylpentane);4,4-dimethylpentane-1,2-diol;1-fluoro-3,3-dimethylbutane;N,N,3,3-tetramethylbutan-1-amine has a molecular weight of 2846.96 g/mol, XLogP of 45.85, 31 rotatable bonds, 8 hydrogen bond donors, and 19 hydrogen bond acceptors.

Where does this data come from?

All data for 1-bromo-3,3-dimethylbutane;bis(tert-butylcyclohexane);4-tert-butyl-1-methylpiperidine;4-tert-butylpiperidine;3,3-dimethylbutan-1-amine;2-(3,3-dimethylbutoxy)ethanamine;1-(3,3-dimethylbutyl)-4-methylpiperazine;4-(3,3-dimethylbutyl)morpholine;1-(3,3-dimethylbutyl)piperazine;tris(1-(3,3-dimethylbutyl)piperidine);6,6-dimethylheptan-1-amine;4,4-dimethylpentan-1-amine;bis(2,2-dimethylpentane);4,4-dimethylpentane-1,2-diol;1-fluoro-3,3-dimethylbutane;N,N,3,3-tetramethylbutan-1-amine is sourced from PubChem (CID 158205262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).