tris((2R,4R)-4-[2-(2-ethoxyethoxy)ethoxy]-2-ethyl-1-methylpyrrolidine);bis((2R,4R)-2-ethyl-4-[2-(2-methoxyethoxy)ethoxy]-1-methylpyrrolidine);4-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]-1-(2-methylpropyl)piperidine;4-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]-1-(2-methylpropyl)piperidine;4-(2-methoxyethoxy)-1-(2-methylpropyl)piperidine

C113H234N8O28 — CID 167533830

IUPACtris((2R,4R)-4-[2-(2-ethoxyethoxy)ethoxy]-2-ethyl-1-methylpyrrolidine);bis((2R,4R)-2-ethyl-4-[2-(2-methoxyethoxy)ethoxy]-1-methylpyrrolidine);4-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]-1-(2-methylpropyl)piperidine;4-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]-1-(2-methylpropyl)piperidine;4-(2-methoxyethoxy)-1-(2-methylpropyl)piperidine
SMILESCCOCCOCCO[C@@H]1C[C@@H](CC)N(C)C1.CCOCCOCCO[C@@H]1C[C@@H](CC)N(C)C1.CCOCCOCCO[C@@H]1C[C@@H](CC)N(C)C1.CC[C@@H]1C[C@@H](OCCOCCOC)CN1C.CC[C@@H]1C[C@@H](OCCOCCOC)CN1C.COCCOC1CCN(CC(C)C)CC1.COCCOCCOCCOCCOC1CCN(CC(C)C)CC1.COCCOCCOCCOCCOCCOC1CCN(CC(C)C)CC1
InChIInChI=1S/C20H41NO6.C18H37NO5.3C13H27NO3.2C12H25NO3.C12H25NO2/c1-19(2)18-21-6-4-20(5-7-21)27-17-16-26-15-14-25-13-12-24-11-10-23-9-8-22-3;1-17(2)16-19-6-4-18(5-7-19)24-15-14-23-13-12-22-11-10-21-9-8-20-3;3*1-4-12-10-13(11-14(12)3)17-9-8-16-7-6-15-5-2;2*1-4-11-9-12(10-13(11)2)16-8-7-15-6-5-14-3;1-11(2)10-13-6-4-12(5-7-13)15-9-8-14-3/h19-20H,4-18H2,1-3H3;17-18H,4-16H2,1-3H3;3*12-13H,4-11H2,1-3H3;2*11-12H,4-10H2,1-3H3;11-12H,4-10H2,1-3H3/t;;3*12-,13-;2*11-,12-;/m..11111./s1
InChIKeyAHYSWLARWBQINZ-LBCMQLDKSA-N
MW2153.14 g/mol
LogP12.34
Rot. Bonds82

About tris((2R,4R)-4-[2-(2-ethoxyethoxy)ethoxy]-2-ethyl-1-methylpyrrolidine);bis((2R,4R)-2-ethyl-4-[2-(2-methoxyethoxy)ethoxy]-1-methylpyrrolidine);4-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]-1-(2-methylpropyl)piperidine;4-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]-1-(2-methylpropyl)piperidine;4-(2-methoxyethoxy)-1-(2-methylpropyl)piperidine

tris((2R,4R)-4-[2-(2-ethoxyethoxy)ethoxy]-2-ethyl-1-methylpyrrolidine);bis((2R,4R)-2-ethyl-4-[2-(2-methoxyethoxy)ethoxy]-1-methylpyrrolidine);4-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]-1-(2-methylpropyl)piperidine;4-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]-1-(2-methylpropyl)piperidine;4-(2-methoxyethoxy)-1-(2-methylpropyl)piperidine (PubChem CID 167533830) has the molecular formula C113H234N8O28 and a molecular weight of 2153.14 g/mol. Its IUPAC name is tris((2R,4R)-4-[2-(2-ethoxyethoxy)ethoxy]-2-ethyl-1-methylpyrrolidine);bis((2R,4R)-2-ethyl-4-[2-(2-methoxyethoxy)ethoxy]-1-methylpyrrolidine);4-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]-1-(2-methylpropyl)piperidine;4-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]-1-(2-methylpropyl)piperidine;4-(2-methoxyethoxy)-1-(2-methylpropyl)piperidine.

Molecular Properties

Compound Nametris((2R,4R)-4-[2-(2-ethoxyethoxy)ethoxy]-2-ethyl-1-methylpyrrolidine);bis((2R,4R)-2-ethyl-4-[2-(2-methoxyethoxy)ethoxy]-1-methylpyrrolidine);4-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]-1-(2-methylpropyl)piperidine;4-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]-1-(2-methylpropyl)piperidine;4-(2-methoxyethoxy)-1-(2-methylpropyl)piperidine
PubChem CID167533830
Molecular FormulaC113H234N8O28
Molecular Weight2153.14 g/mol
Exact Mass2151.71
IUPAC Nametris((2R,4R)-4-[2-(2-ethoxyethoxy)ethoxy]-2-ethyl-1-methylpyrrolidine);bis((2R,4R)-2-ethyl-4-[2-(2-methoxyethoxy)ethoxy]-1-methylpyrrolidine);4-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]-1-(2-methylpropyl)piperidine;4-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]-1-(2-methylpropyl)piperidine;4-(2-methoxyethoxy)-1-(2-methylpropyl)piperidine
SMILESCCOCCOCCO[C@@H]1C[C@@H](CC)N(C)C1.CCOCCOCCO[C@@H]1C[C@@H](CC)N(C)C1.CCOCCOCCO[C@@H]1C[C@@H](CC)N(C)C1.CC[C@@H]1C[C@@H](OCCOCCOC)CN1C.CC[C@@H]1C[C@@H](OCCOCCOC)CN1C.COCCOC1CCN(CC(C)C)CC1.COCCOCCOCCOCCOC1CCN(CC(C)C)CC1.COCCOCCOCCOCCOCCOC1CCN(CC(C)C)CC1
InChIInChI=1S/C20H41NO6.C18H37NO5.3C13H27NO3.2C12H25NO3.C12H25NO2/c1-19(2)18-21-6-4-20(5-7-21)27-17-16-26-15-14-25-13-12-24-11-10-23-9-8-22-3;1-17(2)16-19-6-4-18(5-7-19)24-15-14-23-13-12-22-11-10-21-9-8-20-3;3*1-4-12-10-13(11-14(12)3)17-9-8-16-7-6-15-5-2;2*1-4-11-9-12(10-13(11)2)16-8-7-15-6-5-14-3;1-11(2)10-13-6-4-12(5-7-13)15-9-8-14-3/h19-20H,4-18H2,1-3H3;17-18H,4-16H2,1-3H3;3*12-13H,4-11H2,1-3H3;2*11-12H,4-10H2,1-3H3;11-12H,4-10H2,1-3H3/t;;3*12-,13-;2*11-,12-;/m..11111./s1
InChIKeyAHYSWLARWBQINZ-LBCMQLDKSA-N
XLogP12.34
TPSA284.36 Ų
H-Bond Donors
H-Bond Acceptors36
Rotatable Bonds82
Heavy Atoms149
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002153.14
LogP ≤ 512.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1036

Computed Properties (RDKit)

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

Analyze tris((2R,4R)-4-[2-(2-ethoxyethoxy)ethoxy]-2-ethyl-1-methylpyrrolidine);bis((2R,4R)-2-ethyl-4-[2-(2-methoxyethoxy)ethoxy]-1-methylpyrrolidine);4-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]-1-(2-methylpropyl)piperidine;4-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]-1-(2-methylpropyl)piperidine;4-(2-methoxyethoxy)-1-(2-methylpropyl)piperidine with MolForge

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Related Compounds

(2R,4R)-2-ethyl-4-[2-(2-methoxyethoxy)ethoxy]-1-methylpyrrolidine
CID 166035268
4-[2-[2-[2-[2-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-1-(2-methylpropyl)piperidine
CID 166035331
4-[2-(2-ethoxyethoxy)ethoxy]-1-propylpiperidine
CID 156885045
(3R)-1-butyl-3-[2-(2-methoxyethoxy)ethoxy]pyrrolidine
CID 177319162
ethane;4-(2-methoxyethoxy)-1-propylpiperidine
CID 156885231
1-[4-(2-ethoxyethoxy)piperidin-1-yl]propan-1-one
CID 60775999
1-propan-2-yl-4-[2-[2-[2-[2-[2-(2-propoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]piperidine
CID 174243308
N-(2-ethoxyethyl)-1-(2-methylpropyl)piperidin-4-amine
CID 115709922
3-(2-methoxyethoxy)-1-[3-[1-(2-methylpropyl)piperidin-4-yl]pyrrolidin-1-yl]propan-1-one
CID 170230954
3-[1-[2-hydroxy-3-(2-methoxyethoxy)propyl]piperidin-4-yl]oxypropanoic acid
CID 106991448
N,N-dimethyl-3-[1-(2-methylpropyl)piperidin-4-yl]oxypropan-1-amine
CID 169214901
1-(2-methoxyethyl)-4-[[(3S)-3-[1-(2-methylpropyl)piperidin-4-yl]pyrrolidin-1-yl]methyl]piperidine
CID 42392613

Frequently Asked Questions

What is the IUPAC name of tris((2R,4R)-4-[2-(2-ethoxyethoxy)ethoxy]-2-ethyl-1-methylpyrrolidine);bis((2R,4R)-2-ethyl-4-[2-(2-methoxyethoxy)ethoxy]-1-methylpyrrolidine);4-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]-1-(2-methylpropyl)piperidine;4-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]-1-(2-methylpropyl)piperidine;4-(2-methoxyethoxy)-1-(2-methylpropyl)piperidine?
The IUPAC name of tris((2R,4R)-4-[2-(2-ethoxyethoxy)ethoxy]-2-ethyl-1-methylpyrrolidine);bis((2R,4R)-2-ethyl-4-[2-(2-methoxyethoxy)ethoxy]-1-methylpyrrolidine);4-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]-1-(2-methylpropyl)piperidine;4-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]-1-(2-methylpropyl)piperidine;4-(2-methoxyethoxy)-1-(2-methylpropyl)piperidine (CID 167533830) is tris((2R,4R)-4-[2-(2-ethoxyethoxy)ethoxy]-2-ethyl-1-methylpyrrolidine);bis((2R,4R)-2-ethyl-4-[2-(2-methoxyethoxy)ethoxy]-1-methylpyrrolidine);4-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]-1-(2-methylpropyl)piperidine;4-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]-1-(2-methylpropyl)piperidine;4-(2-methoxyethoxy)-1-(2-methylpropyl)piperidine.
What is the SMILES notation for tris((2R,4R)-4-[2-(2-ethoxyethoxy)ethoxy]-2-ethyl-1-methylpyrrolidine);bis((2R,4R)-2-ethyl-4-[2-(2-methoxyethoxy)ethoxy]-1-methylpyrrolidine);4-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]-1-(2-methylpropyl)piperidine;4-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]-1-(2-methylpropyl)piperidine;4-(2-methoxyethoxy)-1-(2-methylpropyl)piperidine?
The canonical SMILES for tris((2R,4R)-4-[2-(2-ethoxyethoxy)ethoxy]-2-ethyl-1-methylpyrrolidine);bis((2R,4R)-2-ethyl-4-[2-(2-methoxyethoxy)ethoxy]-1-methylpyrrolidine);4-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]-1-(2-methylpropyl)piperidine;4-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]-1-(2-methylpropyl)piperidine;4-(2-methoxyethoxy)-1-(2-methylpropyl)piperidine is CCOCCOCCO[C@@H]1C[C@@H](CC)N(C)C1.CCOCCOCCO[C@@H]1C[C@@H](CC)N(C)C1.CCOCCOCCO[C@@H]1C[C@@H](CC)N(C)C1.CC[C@@H]1C[C@@H](OCCOCCOC)CN1C.CC[C@@H]1C[C@@H](OCCOCCOC)CN1C.COCCOC1CCN(CC(C)C)CC1.COCCOCCOCCOCCOC1CCN(CC(C)C)CC1.COCCOCCOCCOCCOCCOC1CCN(CC(C)C)CC1.
What is the InChIKey of tris((2R,4R)-4-[2-(2-ethoxyethoxy)ethoxy]-2-ethyl-1-methylpyrrolidine);bis((2R,4R)-2-ethyl-4-[2-(2-methoxyethoxy)ethoxy]-1-methylpyrrolidine);4-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]-1-(2-methylpropyl)piperidine;4-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]-1-(2-methylpropyl)piperidine;4-(2-methoxyethoxy)-1-(2-methylpropyl)piperidine?
The InChIKey is AHYSWLARWBQINZ-LBCMQLDKSA-N. The full InChI is InChI=1S/C20H41NO6.C18H37NO5.3C13H27NO3.2C12H25NO3.C12H25NO2/c1-19(2)18-21-6-4-20(5-7-21)27-17-16-26-15-14-25-13-12-24-11-10-23-9-8-22-3;1-17(2)16-19-6-4-18(5-7-19)24-15-14-23-13-12-22-11-10-21-9-8-20-3;3*1-4-12-10-13(11-14(12)3)17-9-8-16-7-6-15-5-2;2*1-4-11-9-12(10-13(11)2)16-8-7-15-6-5-14-3;1-11(2)10-13-6-4-12(5-7-13)15-9-8-14-3/h19-20H,4-18H2,1-3H3;17-18H,4-16H2,1-3H3;3*12-13H,4-11H2,1-3H3;2*11-12H,4-10H2,1-3H3;11-12H,4-10H2,1-3H3/t;;3*12-,13-;2*11-,12-;/m..11111./s1.
What are the key properties of tris((2R,4R)-4-[2-(2-ethoxyethoxy)ethoxy]-2-ethyl-1-methylpyrrolidine);bis((2R,4R)-2-ethyl-4-[2-(2-methoxyethoxy)ethoxy]-1-methylpyrrolidine);4-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]-1-(2-methylpropyl)piperidine;4-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]-1-(2-methylpropyl)piperidine;4-(2-methoxyethoxy)-1-(2-methylpropyl)piperidine?
tris((2R,4R)-4-[2-(2-ethoxyethoxy)ethoxy]-2-ethyl-1-methylpyrrolidine);bis((2R,4R)-2-ethyl-4-[2-(2-methoxyethoxy)ethoxy]-1-methylpyrrolidine);4-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]-1-(2-methylpropyl)piperidine;4-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]-1-(2-methylpropyl)piperidine;4-(2-methoxyethoxy)-1-(2-methylpropyl)piperidine has a molecular weight of 2153.14 g/mol, XLogP of 12.34, 82 rotatable bonds, 0 hydrogen bond donors, and 36 hydrogen bond acceptors.
Where does this data come from?
All data for tris((2R,4R)-4-[2-(2-ethoxyethoxy)ethoxy]-2-ethyl-1-methylpyrrolidine);bis((2R,4R)-2-ethyl-4-[2-(2-methoxyethoxy)ethoxy]-1-methylpyrrolidine);4-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]-1-(2-methylpropyl)piperidine;4-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]-1-(2-methylpropyl)piperidine;4-(2-methoxyethoxy)-1-(2-methylpropyl)piperidine is sourced from PubChem (CID 167533830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).