2-tert-butylcyclohexan-1-ol;3,3-dimethylbutan-1-ol;1-(3,3-dimethylbutyl)pyrrolidine;2,2-dimethylheptane;6,6-dimethylheptan-1-ol;5,5-dimethylhexan-1-ol;2,2-dimethyloctane;7,7-dimethyloctan-1-ol;4,4-dimethylpentane-1,2-diol;4,4-dimethylpentan-1-ol;N-ethyl-N,3,3-trimethylbutan-1-amine;1-methoxy-4,4-dimethylpentane;N,N,3,3-tetramethylbutan-1-amine;N,N,5,5-tetramethylhexan-1-amine;N,N,4,4-tetramethylpentan-1-amine;N,N,2,2-tetramethylpropan-1-amine;2,2,5-trimethylhexane

C146H328N6O9 — CID 160619178

About 2-tert-butylcyclohexan-1-ol;3,3-dimethylbutan-1-ol;1-(3,3-dimethylbutyl)pyrrolidine;2,2-dimethylheptane;6,6-dimethylheptan-1-ol;5,5-dimethylhexan-1-ol;2,2-dimethyloctane;7,7-dimethyloctan-1-ol;4,4-dimethylpentane-1,2-diol;4,4-dimethylpentan-1-ol;N-ethyl-N,3,3-trimethylbutan-1-amine;1-methoxy-4,4-dimethylpentane;N,N,3,3-tetramethylbutan-1-amine;N,N,5,5-tetramethylhexan-1-amine;N,N,4,4-tetramethylpentan-1-amine;N,N,2,2-tetramethylpropan-1-amine;2,2,5-trimethylhexane

2-tert-butylcyclohexan-1-ol;3,3-dimethylbutan-1-ol;1-(3,3-dimethylbutyl)pyrrolidine;2,2-dimethylheptane;6,6-dimethylheptan-1-ol;5,5-dimethylhexan-1-ol;2,2-dimethyloctane;7,7-dimethyloctan-1-ol;4,4-dimethylpentane-1,2-diol;4,4-dimethylpentan-1-ol;N-ethyl-N,3,3-trimethylbutan-1-amine;1-methoxy-4,4-dimethylpentane;N,N,3,3-tetramethylbutan-1-amine;N,N,5,5-tetramethylhexan-1-amine;N,N,4,4-tetramethylpentan-1-amine;N,N,2,2-tetramethylpropan-1-amine;2,2,5-trimethylhexane (PubChem CID 160619178) has the molecular formula C146H328N6O9 and a molecular weight of 2312.26 g/mol. Its IUPAC name is 2-tert-butylcyclohexan-1-ol;3,3-dimethylbutan-1-ol;1-(3,3-dimethylbutyl)pyrrolidine;2,2-dimethylheptane;6,6-dimethylheptan-1-ol;5,5-dimethylhexan-1-ol;2,2-dimethyloctane;7,7-dimethyloctan-1-ol;4,4-dimethylpentane-1,2-diol;4,4-dimethylpentan-1-ol;N-ethyl-N,3,3-trimethylbutan-1-amine;1-methoxy-4,4-dimethylpentane;N,N,3,3-tetramethylbutan-1-amine;N,N,5,5-tetramethylhexan-1-amine;N,N,4,4-tetramethylpentan-1-amine;N,N,2,2-tetramethylpropan-1-amine;2,2,5-trimethylhexane.

Molecular Properties

• Compound Name: 2-tert-butylcyclohexan-1-ol;3,3-dimethylbutan-1-ol;1-(3,3-dimethylbutyl)pyrrolidine;2,2-dimethylheptane;6,6-dimethylheptan-1-ol;5,5-dimethylhexan-1-ol;2,2-dimethyloctane;7,7-dimethyloctan-1-ol;4,4-dimethylpentane-1,2-diol;4,4-dimethylpentan-1-ol;N-ethyl-N,3,3-trimethylbutan-1-amine;1-methoxy-4,4-dimethylpentane;N,N,3,3-tetramethylbutan-1-amine;N,N,5,5-tetramethylhexan-1-amine;N,N,4,4-tetramethylpentan-1-amine;N,N,2,2-tetramethylpropan-1-amine;2,2,5-trimethylhexane
• PubChem CID: 160619178
• Molecular Formula: C146H328N6O9
• Molecular Weight: 2312.26 g/mol
• Exact Mass: 2310.54
• IUPAC Name: 2-tert-butylcyclohexan-1-ol;3,3-dimethylbutan-1-ol;1-(3,3-dimethylbutyl)pyrrolidine;2,2-dimethylheptane;6,6-dimethylheptan-1-ol;5,5-dimethylhexan-1-ol;2,2-dimethyloctane;7,7-dimethyloctan-1-ol;4,4-dimethylpentane-1,2-diol;4,4-dimethylpentan-1-ol;N-ethyl-N,3,3-trimethylbutan-1-amine;1-methoxy-4,4-dimethylpentane;N,N,3,3-tetramethylbutan-1-amine;N,N,5,5-tetramethylhexan-1-amine;N,N,4,4-tetramethylpentan-1-amine;N,N,2,2-tetramethylpropan-1-amine;2,2,5-trimethylhexane
• SMILES: CC(C)(C)C1CCCCC1O.CC(C)(C)CC(O)CO.CC(C)(C)CCCCCCO.CC(C)(C)CCCCCO.CC(C)(C)CCCCO.CC(C)(C)CCCO.CC(C)(C)CCN1CCCC1.CC(C)(C)CCO.CC(C)CCC(C)(C)C.CCCCCC(C)(C)C.CCCCCCC(C)(C)C.CCN(C)CCC(C)(C)C.CN(C)CC(C)(C)C.CN(C)CCC(C)(C)C.CN(C)CCCC(C)(C)C.CN(C)CCCCC(C)(C)C.COCCCC(C)(C)C
• InChI: InChI=1S/C10H21N.C10H23N.C10H20O.C10H22O.C10H22.2C9H21N.C9H20O.2C9H20.C8H19N.2C8H18O.C7H17N.C7H16O2.C7H16O.C6H14O/c1-10(2,3)6-9-11-7-4-5-8-11;1-10(2,3)8-6-7-9-11(4)5;1-10(2,3)8-6-4-5-7-9(8)11;1-10(2,3)8-6-4-5-7-9-11;1-5-6-7-8-9-10(2,3)4;1-9(2,3)7-6-8-10(4)5;1-6-10(5)8-7-9(2,3)4;1-9(2,3)7-5-4-6-8-10;1-8(2)6-7-9(3,4)5;1-5-6-7-8-9(2,3)4;1-8(2,3)6-7-9(4)5;1-8(2,3)6-5-7-9-4;1-8(2,3)6-4-5-7-9;1-7(2,3)6-8(4)5;1-7(2,3)4-6(9)5-8;1-7(2,3)5-4-6-8;1-6(2,3)4-5-7/h4-9H2,1-3H3;6-9H2,1-5H3;8-9,11H,4-7H2,1-3H3;11H,4-9H2,1-3H3;5-9H2,1-4H3;2*6-8H2,1-5H3;10H,4-8H2,1-3H3;8H,6-7H2,1-5H3;5-8H2,1-4H3;6-7H2,1-5H3;5-7H2,1-4H3;9H,4-7H2,1-3H3;6H2,1-5H3;6,8-9H,4-5H2,1-3H3;8H,4-6H2,1-3H3;7H,4-5H2,1-3H3
• InChIKey: RGMDEVMFGRJIKC-UHFFFAOYSA-N
• XLogP: 41.49
• TPSA: 190.51 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 15
• Rotatable Bonds: 44
• Heavy Atoms: 161
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2312.26
LogP ≤ 5	41.49
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	15

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-tert-butylcyclohexan-1-ol;3,3-dimethylbutan-1-ol;1-(3,3-dimethylbutyl)pyrrolidine;2,2-dimethylheptane;6,6-dimethylheptan-1-ol;5,5-dimethylhexan-1-ol;2,2-dimethyloctane;7,7-dimethyloctan-1-ol;4,4-dimethylpentane-1,2-diol;4,4-dimethylpentan-1-ol;N-ethyl-N,3,3-trimethylbutan-1-amine;1-methoxy-4,4-dimethylpentane;N,N,3,3-tetramethylbutan-1-amine;N,N,5,5-tetramethylhexan-1-amine;N,N,4,4-tetramethylpentan-1-amine;N,N,2,2-tetramethylpropan-1-amine;2,2,5-trimethylhexane?

The IUPAC name of 2-tert-butylcyclohexan-1-ol;3,3-dimethylbutan-1-ol;1-(3,3-dimethylbutyl)pyrrolidine;2,2-dimethylheptane;6,6-dimethylheptan-1-ol;5,5-dimethylhexan-1-ol;2,2-dimethyloctane;7,7-dimethyloctan-1-ol;4,4-dimethylpentane-1,2-diol;4,4-dimethylpentan-1-ol;N-ethyl-N,3,3-trimethylbutan-1-amine;1-methoxy-4,4-dimethylpentane;N,N,3,3-tetramethylbutan-1-amine;N,N,5,5-tetramethylhexan-1-amine;N,N,4,4-tetramethylpentan-1-amine;N,N,2,2-tetramethylpropan-1-amine;2,2,5-trimethylhexane (CID 160619178) is 2-tert-butylcyclohexan-1-ol;3,3-dimethylbutan-1-ol;1-(3,3-dimethylbutyl)pyrrolidine;2,2-dimethylheptane;6,6-dimethylheptan-1-ol;5,5-dimethylhexan-1-ol;2,2-dimethyloctane;7,7-dimethyloctan-1-ol;4,4-dimethylpentane-1,2-diol;4,4-dimethylpentan-1-ol;N-ethyl-N,3,3-trimethylbutan-1-amine;1-methoxy-4,4-dimethylpentane;N,N,3,3-tetramethylbutan-1-amine;N,N,5,5-tetramethylhexan-1-amine;N,N,4,4-tetramethylpentan-1-amine;N,N,2,2-tetramethylpropan-1-amine;2,2,5-trimethylhexane.

What is the SMILES notation for 2-tert-butylcyclohexan-1-ol;3,3-dimethylbutan-1-ol;1-(3,3-dimethylbutyl)pyrrolidine;2,2-dimethylheptane;6,6-dimethylheptan-1-ol;5,5-dimethylhexan-1-ol;2,2-dimethyloctane;7,7-dimethyloctan-1-ol;4,4-dimethylpentane-1,2-diol;4,4-dimethylpentan-1-ol;N-ethyl-N,3,3-trimethylbutan-1-amine;1-methoxy-4,4-dimethylpentane;N,N,3,3-tetramethylbutan-1-amine;N,N,5,5-tetramethylhexan-1-amine;N,N,4,4-tetramethylpentan-1-amine;N,N,2,2-tetramethylpropan-1-amine;2,2,5-trimethylhexane?

The canonical SMILES for 2-tert-butylcyclohexan-1-ol;3,3-dimethylbutan-1-ol;1-(3,3-dimethylbutyl)pyrrolidine;2,2-dimethylheptane;6,6-dimethylheptan-1-ol;5,5-dimethylhexan-1-ol;2,2-dimethyloctane;7,7-dimethyloctan-1-ol;4,4-dimethylpentane-1,2-diol;4,4-dimethylpentan-1-ol;N-ethyl-N,3,3-trimethylbutan-1-amine;1-methoxy-4,4-dimethylpentane;N,N,3,3-tetramethylbutan-1-amine;N,N,5,5-tetramethylhexan-1-amine;N,N,4,4-tetramethylpentan-1-amine;N,N,2,2-tetramethylpropan-1-amine;2,2,5-trimethylhexane is CC(C)(C)C1CCCCC1O.CC(C)(C)CC(O)CO.CC(C)(C)CCCCCCO.CC(C)(C)CCCCCO.CC(C)(C)CCCCO.CC(C)(C)CCCO.CC(C)(C)CCN1CCCC1.CC(C)(C)CCO.CC(C)CCC(C)(C)C.CCCCCC(C)(C)C.CCCCCCC(C)(C)C.CCN(C)CCC(C)(C)C.CN(C)CC(C)(C)C.CN(C)CCC(C)(C)C.CN(C)CCCC(C)(C)C.CN(C)CCCCC(C)(C)C.COCCCC(C)(C)C.

What is the InChIKey of 2-tert-butylcyclohexan-1-ol;3,3-dimethylbutan-1-ol;1-(3,3-dimethylbutyl)pyrrolidine;2,2-dimethylheptane;6,6-dimethylheptan-1-ol;5,5-dimethylhexan-1-ol;2,2-dimethyloctane;7,7-dimethyloctan-1-ol;4,4-dimethylpentane-1,2-diol;4,4-dimethylpentan-1-ol;N-ethyl-N,3,3-trimethylbutan-1-amine;1-methoxy-4,4-dimethylpentane;N,N,3,3-tetramethylbutan-1-amine;N,N,5,5-tetramethylhexan-1-amine;N,N,4,4-tetramethylpentan-1-amine;N,N,2,2-tetramethylpropan-1-amine;2,2,5-trimethylhexane?

The InChIKey is RGMDEVMFGRJIKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N.C10H23N.C10H20O.C10H22O.C10H22.2C9H21N.C9H20O.2C9H20.C8H19N.2C8H18O.C7H17N.C7H16O2.C7H16O.C6H14O/c1-10(2,3)6-9-11-7-4-5-8-11;1-10(2,3)8-6-7-9-11(4)5;1-10(2,3)8-6-4-5-7-9(8)11;1-10(2,3)8-6-4-5-7-9-11;1-5-6-7-8-9-10(2,3)4;1-9(2,3)7-6-8-10(4)5;1-6-10(5)8-7-9(2,3)4;1-9(2,3)7-5-4-6-8-10;1-8(2)6-7-9(3,4)5;1-5-6-7-8-9(2,3)4;1-8(2,3)6-7-9(4)5;1-8(2,3)6-5-7-9-4;1-8(2,3)6-4-5-7-9;1-7(2,3)6-8(4)5;1-7(2,3)4-6(9)5-8;1-7(2,3)5-4-6-8;1-6(2,3)4-5-7/h4-9H2,1-3H3;6-9H2,1-5H3;8-9,11H,4-7H2,1-3H3;11H,4-9H2,1-3H3;5-9H2,1-4H3;2*6-8H2,1-5H3;10H,4-8H2,1-3H3;8H,6-7H2,1-5H3;5-8H2,1-4H3;6-7H2,1-5H3;5-7H2,1-4H3;9H,4-7H2,1-3H3;6H2,1-5H3;6,8-9H,4-5H2,1-3H3;8H,4-6H2,1-3H3;7H,4-5H2,1-3H3.

What are the key properties of 2-tert-butylcyclohexan-1-ol;3,3-dimethylbutan-1-ol;1-(3,3-dimethylbutyl)pyrrolidine;2,2-dimethylheptane;6,6-dimethylheptan-1-ol;5,5-dimethylhexan-1-ol;2,2-dimethyloctane;7,7-dimethyloctan-1-ol;4,4-dimethylpentane-1,2-diol;4,4-dimethylpentan-1-ol;N-ethyl-N,3,3-trimethylbutan-1-amine;1-methoxy-4,4-dimethylpentane;N,N,3,3-tetramethylbutan-1-amine;N,N,5,5-tetramethylhexan-1-amine;N,N,4,4-tetramethylpentan-1-amine;N,N,2,2-tetramethylpropan-1-amine;2,2,5-trimethylhexane?

2-tert-butylcyclohexan-1-ol;3,3-dimethylbutan-1-ol;1-(3,3-dimethylbutyl)pyrrolidine;2,2-dimethylheptane;6,6-dimethylheptan-1-ol;5,5-dimethylhexan-1-ol;2,2-dimethyloctane;7,7-dimethyloctan-1-ol;4,4-dimethylpentane-1,2-diol;4,4-dimethylpentan-1-ol;N-ethyl-N,3,3-trimethylbutan-1-amine;1-methoxy-4,4-dimethylpentane;N,N,3,3-tetramethylbutan-1-amine;N,N,5,5-tetramethylhexan-1-amine;N,N,4,4-tetramethylpentan-1-amine;N,N,2,2-tetramethylpropan-1-amine;2,2,5-trimethylhexane has a molecular weight of 2312.26 g/mol, XLogP of 41.49, 44 rotatable bonds, 8 hydrogen bond donors, and 15 hydrogen bond acceptors.

Where does this data come from?

All data for 2-tert-butylcyclohexan-1-ol;3,3-dimethylbutan-1-ol;1-(3,3-dimethylbutyl)pyrrolidine;2,2-dimethylheptane;6,6-dimethylheptan-1-ol;5,5-dimethylhexan-1-ol;2,2-dimethyloctane;7,7-dimethyloctan-1-ol;4,4-dimethylpentane-1,2-diol;4,4-dimethylpentan-1-ol;N-ethyl-N,3,3-trimethylbutan-1-amine;1-methoxy-4,4-dimethylpentane;N,N,3,3-tetramethylbutan-1-amine;N,N,5,5-tetramethylhexan-1-amine;N,N,4,4-tetramethylpentan-1-amine;N,N,2,2-tetramethylpropan-1-amine;2,2,5-trimethylhexane is sourced from PubChem (CID 160619178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).