1-ethyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(3R)-1-ethyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(3S)-1-ethyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;bis(1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine);bis(1-methyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine);(2S)-1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(2R)-1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(3R)-1-methyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(3S)-1-methyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;3-methyl-1-[3-[(2-methylpropan-2-yl)oxy]propyl]pyrrolidine;(3R)-3-methyl-1-[3-[(2-methylpropan-2-yl)oxy]propyl]pyrrolidine;(3S)-3-methyl-1-[3-[(2-methylpropan-2-yl)oxy]propyl]pyrrolidine;hexakis((2-methylpropan-2-yl)oxymethylcyclopentane)

C209H432N14O20 — CID 158658379

IUPAC1-ethyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(3R)-1-ethyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(3S)-1-ethyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;bis(1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine);bis(1-methyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine);(2S)-1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(2R)-1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(3R)-1-methyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(3S)-1-methyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;3-methyl-1-[3-[(2-methylpropan-2-yl)oxy]propyl]pyrrolidine;(3R)-3-methyl-1-[3-[(2-methylpropan-2-yl)oxy]propyl]pyrrolidine;(3S)-3-methyl-1-[3-[(2-methylpropan-2-yl)oxy]propyl]pyrrolidine;hexakis((2-methylpropan-2-yl)oxymethylcyclopentane)
SMILESCC(C)(C)OCC1CCCC1.CC(C)(C)OCC1CCCC1.CC(C)(C)OCC1CCCC1.CC(C)(C)OCC1CCCC1.CC(C)(C)OCC1CCCC1.CC(C)(C)OCC1CCCC1.CC1CCN(CCCOC(C)(C)C)C1.CCN1CCC(COC(C)(C)C)C1.CCN1CC[C@@H](COC(C)(C)C)C1.CCN1CC[C@H](COC(C)(C)C)C1.CN1CCC(COC(C)(C)C)C1.CN1CCC(COC(C)(C)C)C1.CN1CCCC1COC(C)(C)C.CN1CCCC1COC(C)(C)C.CN1CCC[C@@H]1COC(C)(C)C.CN1CCC[C@H]1COC(C)(C)C.CN1CC[C@@H](COC(C)(C)C)C1.CN1CC[C@H](COC(C)(C)C)C1.C[C@@H]1CCN(CCCOC(C)(C)C)C1.C[C@H]1CCN(CCCOC(C)(C)C)C1
InChIInChI=1S/3C12H25NO.3C11H23NO.8C10H21NO.6C10H20O/c3*1-11-6-8-13(10-11)7-5-9-14-12(2,3)4;3*1-5-12-7-6-10(8-12)9-13-11(2,3)4;4*1-10(2,3)12-8-9-5-6-11(4)7-9;4*1-10(2,3)12-8-9-6-5-7-11(9)4;6*1-10(2,3)11-8-9-6-4-5-7-9/h3*11H,5-10H2,1-4H3;3*10H,5-9H2,1-4H3;8*9H,5-8H2,1-4H3;6*9H,4-8H2,1-3H3/t2*11-;;2*10-;;2*9-;;;2*9-;;;;;;;;/m10.10.10..10......../s1
InChIKeyICLBHZOMWAZYJX-LTEKQMGJSA-N
MW3461.83 g/mol
LogP46.58
Rot. Bonds49

About 1-ethyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(3R)-1-ethyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(3S)-1-ethyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;bis(1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine);bis(1-methyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine);(2S)-1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(2R)-1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(3R)-1-methyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(3S)-1-methyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;3-methyl-1-[3-[(2-methylpropan-2-yl)oxy]propyl]pyrrolidine;(3R)-3-methyl-1-[3-[(2-methylpropan-2-yl)oxy]propyl]pyrrolidine;(3S)-3-methyl-1-[3-[(2-methylpropan-2-yl)oxy]propyl]pyrrolidine;hexakis((2-methylpropan-2-yl)oxymethylcyclopentane)

1-ethyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(3R)-1-ethyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(3S)-1-ethyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;bis(1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine);bis(1-methyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine);(2S)-1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(2R)-1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(3R)-1-methyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(3S)-1-methyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;3-methyl-1-[3-[(2-methylpropan-2-yl)oxy]propyl]pyrrolidine;(3R)-3-methyl-1-[3-[(2-methylpropan-2-yl)oxy]propyl]pyrrolidine;(3S)-3-methyl-1-[3-[(2-methylpropan-2-yl)oxy]propyl]pyrrolidine;hexakis((2-methylpropan-2-yl)oxymethylcyclopentane) (PubChem CID 158658379) has the molecular formula C209H432N14O20 and a molecular weight of 3461.83 g/mol. Its IUPAC name is 1-ethyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(3R)-1-ethyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(3S)-1-ethyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;bis(1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine);bis(1-methyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine);(2S)-1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(2R)-1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(3R)-1-methyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(3S)-1-methyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;3-methyl-1-[3-[(2-methylpropan-2-yl)oxy]propyl]pyrrolidine;(3R)-3-methyl-1-[3-[(2-methylpropan-2-yl)oxy]propyl]pyrrolidine;(3S)-3-methyl-1-[3-[(2-methylpropan-2-yl)oxy]propyl]pyrrolidine;hexakis((2-methylpropan-2-yl)oxymethylcyclopentane).

Molecular Properties

Compound Name1-ethyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(3R)-1-ethyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(3S)-1-ethyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;bis(1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine);bis(1-methyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine);(2S)-1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(2R)-1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(3R)-1-methyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(3S)-1-methyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;3-methyl-1-[3-[(2-methylpropan-2-yl)oxy]propyl]pyrrolidine;(3R)-3-methyl-1-[3-[(2-methylpropan-2-yl)oxy]propyl]pyrrolidine;(3S)-3-methyl-1-[3-[(2-methylpropan-2-yl)oxy]propyl]pyrrolidine;hexakis((2-methylpropan-2-yl)oxymethylcyclopentane)
PubChem CID158658379
Molecular FormulaC209H432N14O20
Molecular Weight3461.83 g/mol
Exact Mass3459.32
IUPAC Name1-ethyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(3R)-1-ethyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(3S)-1-ethyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;bis(1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine);bis(1-methyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine);(2S)-1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(2R)-1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(3R)-1-methyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(3S)-1-methyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;3-methyl-1-[3-[(2-methylpropan-2-yl)oxy]propyl]pyrrolidine;(3R)-3-methyl-1-[3-[(2-methylpropan-2-yl)oxy]propyl]pyrrolidine;(3S)-3-methyl-1-[3-[(2-methylpropan-2-yl)oxy]propyl]pyrrolidine;hexakis((2-methylpropan-2-yl)oxymethylcyclopentane)
SMILESCC(C)(C)OCC1CCCC1.CC(C)(C)OCC1CCCC1.CC(C)(C)OCC1CCCC1.CC(C)(C)OCC1CCCC1.CC(C)(C)OCC1CCCC1.CC(C)(C)OCC1CCCC1.CC1CCN(CCCOC(C)(C)C)C1.CCN1CCC(COC(C)(C)C)C1.CCN1CC[C@@H](COC(C)(C)C)C1.CCN1CC[C@H](COC(C)(C)C)C1.CN1CCC(COC(C)(C)C)C1.CN1CCC(COC(C)(C)C)C1.CN1CCCC1COC(C)(C)C.CN1CCCC1COC(C)(C)C.CN1CCC[C@@H]1COC(C)(C)C.CN1CCC[C@H]1COC(C)(C)C.CN1CC[C@@H](COC(C)(C)C)C1.CN1CC[C@H](COC(C)(C)C)C1.C[C@@H]1CCN(CCCOC(C)(C)C)C1.C[C@H]1CCN(CCCOC(C)(C)C)C1
InChIInChI=1S/3C12H25NO.3C11H23NO.8C10H21NO.6C10H20O/c3*1-11-6-8-13(10-11)7-5-9-14-12(2,3)4;3*1-5-12-7-6-10(8-12)9-13-11(2,3)4;4*1-10(2,3)12-8-9-5-6-11(4)7-9;4*1-10(2,3)12-8-9-6-5-7-11(9)4;6*1-10(2,3)11-8-9-6-4-5-7-9/h3*11H,5-10H2,1-4H3;3*10H,5-9H2,1-4H3;8*9H,5-8H2,1-4H3;6*9H,4-8H2,1-3H3/t2*11-;;2*10-;;2*9-;;;2*9-;;;;;;;;/m10.10.10..10......../s1
InChIKeyICLBHZOMWAZYJX-LTEKQMGJSA-N
XLogP46.58
TPSA229.96 Ų
H-Bond Donors
H-Bond Acceptors34
Rotatable Bonds49
Heavy Atoms243
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003461.83
LogP ≤ 546.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1034

Computed Properties (RDKit)

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

Analyze 1-ethyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(3R)-1-ethyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(3S)-1-ethyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;bis(1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine);bis(1-methyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine);(2S)-1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(2R)-1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(3R)-1-methyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(3S)-1-methyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;3-methyl-1-[3-[(2-methylpropan-2-yl)oxy]propyl]pyrrolidine;(3R)-3-methyl-1-[3-[(2-methylpropan-2-yl)oxy]propyl]pyrrolidine;(3S)-3-methyl-1-[3-[(2-methylpropan-2-yl)oxy]propyl]pyrrolidine;hexakis((2-methylpropan-2-yl)oxymethylcyclopentane) with MolForge

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Related Compounds

1-cyclobutyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;1-cyclopropyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;1-ethyl-3-[(2-methylpropan-2-yl)oxymethyl]azetidine;1-(1-methylcyclopropyl)-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;1-methyl-3-[(2-methylpropan-2-yl)oxymethyl]azetidine;1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;1-methyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;3-methyl-1-[3-[(2-methylpropan-2-yl)oxy]propyl]pyrrolidine;(3R)-3-methyl-1-[3-[(2-methylpropan-2-yl)oxy]propyl]pyrrolidine;(3S)-3-methyl-1-[3-[(2-methylpropan-2-yl)oxy]propyl]pyrrolidine;bis((2-methylpropan-2-yl)oxymethylcyclopentane);3-[(2-methylpropan-2-yl)oxymethyl]-1-propan-2-ylazetidine
CID 161064957
1-ethyl-3-(propan-2-yloxymethyl)azetidine;1-ethyl-3-(propan-2-yloxymethyl)pyrrolidine;(3R)-1-ethyl-3-(propan-2-yloxymethyl)pyrrolidine;(3S)-1-ethyl-3-(propan-2-yloxymethyl)pyrrolidine;1-methyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(3R)-3-methyl-1-[3-[(2-methylpropan-2-yl)oxy]propyl]pyrrolidine;(3S)-3-methyl-1-[3-[(2-methylpropan-2-yl)oxy]propyl]pyrrolidine;1-methyl-3-(propan-2-yloxymethyl)azetidine;hexakis((2-methylpropan-2-yl)oxymethylcyclopentane);2-[(2-methylpropan-2-yl)oxymethyl]-1-prop-1-en-2-ylpyrrolidine;3-[(2-methylpropan-2-yl)oxymethyl]-1-prop-1-en-2-ylpyrrolidine;(3R)-1-methyl-3-(propan-2-yloxymethyl)pyrrolidine;(3S)-1-methyl-3-(propan-2-yloxymethyl)pyrrolidine;1-[3-[(2-methylpropan-2-yl)oxy]propyl]azetidine;propan-2-yloxymethylcyclobutane;3-(propan-2-yloxymethyl)-1-prop-1-en-2-ylazetidine
CID 159458861
N-tert-butyl-N',N'-dimethylpropane-1,3-diamine;1-ethyl-3-[(2-methylpropan-2-yl)oxymethyl]piperidine;1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]piperidine
CID 159590827
3,3-difluoro-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidine;bis((2S,4S)-1,4-dimethyl-2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine);4-fluoro-4-methyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidine;(2S,4S)-4-methoxy-1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;4-methyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidine;(3S)-3-methyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]pyrrolidine;(3S)-1-methyl-3-[(2-methylpropan-2-yl)oxymethyl]piperidine;(2S)-1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(2R)-1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine
CID 161329111
N-(cyclopentylmethyl)-3,3-dimethylbutan-1-amine;3-methyl-1-[3-[(2-methylpropan-2-yl)oxy]propyl]pyrrolidine;1-[(2-methylpropan-2-yl)oxy]-3-(1-methylpyrrolidin-2-yl)propan-2-ol;1-[(2-methylpropan-2-yl)oxy]-3-(1-methylpyrrolidin-3-yl)propan-2-ol;(2R)-1-[(2-methylpropan-2-yl)oxy]-3-(1-methylpyrrolidin-2-yl)propan-2-ol;(2S)-1-[(2-methylpropan-2-yl)oxy]-3-(1-methylpyrrolidin-2-yl)propan-2-ol;(2R)-1-[(2-methylpropan-2-yl)oxy]-3-(1-methylpyrrolidin-3-yl)propan-2-ol;(2S)-1-[(2-methylpropan-2-yl)oxy]-3-(1-methylpyrrolidin-3-yl)propan-2-ol;1-[(2-methylpropan-2-yl)oxy]-3-(1-prop-1-en-2-ylpyrrolidin-2-yl)propan-2-ol;1-[(2-methylpropan-2-yl)oxy]-3-(1-prop-1-en-2-ylpyrrolidin-3-yl)propan-2-ol;bis(1-[3-[(2-methylpropan-2-yl)oxy]propyl]piperidine)
CID 161465629
(2S)-1-methyl-2-[3-[(2-methylpropan-2-yl)oxy]propyl]pyrrolidine
CID 146334915
1-ethyl-4-[3-[(2-methylpropan-2-yl)oxy]propyl]piperazine
CID 171447106
(3R)-1-[3-[(2-methylpropan-2-yl)oxy]propyl]pyrrolidin-3-ol
CID 59334347
2-[ethyl-[2-[(2-methylpropan-2-yl)oxy]ethyl]amino]ethanol;1-methyl-3-[(2-methylpropan-2-yl)oxy]azetidine;4-methyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidine;1-methyl-4-[(2-methylpropan-2-yl)oxymethyl]piperidine;1-methyl-4-[(2-methylpropan-2-yl)oxy]piperidine;1-methyl-4-[3-[(2-methylpropan-2-yl)oxy]propyl]piperazine;2-[2-[(2-methylpropan-2-yl)oxy]ethyl-propylamino]ethanol;(2-methylpropan-2-yl)oxymethylcyclohexane;(2-methylpropan-2-yl)oxymethylcyclopentane;2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine
CID 157238464
1-methyl-3-[2-(3-methylpyrrolidin-1-yl)ethyl]piperidine
CID 91419718
ethane;1-ethyl-3-methylpyrrolidine
CID 90936593
4-methyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidine
CID 59691701

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(3R)-1-ethyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(3S)-1-ethyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;bis(1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine);bis(1-methyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine);(2S)-1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(2R)-1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(3R)-1-methyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(3S)-1-methyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;3-methyl-1-[3-[(2-methylpropan-2-yl)oxy]propyl]pyrrolidine;(3R)-3-methyl-1-[3-[(2-methylpropan-2-yl)oxy]propyl]pyrrolidine;(3S)-3-methyl-1-[3-[(2-methylpropan-2-yl)oxy]propyl]pyrrolidine;hexakis((2-methylpropan-2-yl)oxymethylcyclopentane)?
The IUPAC name of 1-ethyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(3R)-1-ethyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(3S)-1-ethyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;bis(1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine);bis(1-methyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine);(2S)-1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(2R)-1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(3R)-1-methyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(3S)-1-methyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;3-methyl-1-[3-[(2-methylpropan-2-yl)oxy]propyl]pyrrolidine;(3R)-3-methyl-1-[3-[(2-methylpropan-2-yl)oxy]propyl]pyrrolidine;(3S)-3-methyl-1-[3-[(2-methylpropan-2-yl)oxy]propyl]pyrrolidine;hexakis((2-methylpropan-2-yl)oxymethylcyclopentane) (CID 158658379) is 1-ethyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(3R)-1-ethyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(3S)-1-ethyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;bis(1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine);bis(1-methyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine);(2S)-1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(2R)-1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(3R)-1-methyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(3S)-1-methyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;3-methyl-1-[3-[(2-methylpropan-2-yl)oxy]propyl]pyrrolidine;(3R)-3-methyl-1-[3-[(2-methylpropan-2-yl)oxy]propyl]pyrrolidine;(3S)-3-methyl-1-[3-[(2-methylpropan-2-yl)oxy]propyl]pyrrolidine;hexakis((2-methylpropan-2-yl)oxymethylcyclopentane).
What is the SMILES notation for 1-ethyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(3R)-1-ethyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(3S)-1-ethyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;bis(1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine);bis(1-methyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine);(2S)-1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(2R)-1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(3R)-1-methyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(3S)-1-methyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;3-methyl-1-[3-[(2-methylpropan-2-yl)oxy]propyl]pyrrolidine;(3R)-3-methyl-1-[3-[(2-methylpropan-2-yl)oxy]propyl]pyrrolidine;(3S)-3-methyl-1-[3-[(2-methylpropan-2-yl)oxy]propyl]pyrrolidine;hexakis((2-methylpropan-2-yl)oxymethylcyclopentane)?
The canonical SMILES for 1-ethyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(3R)-1-ethyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(3S)-1-ethyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;bis(1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine);bis(1-methyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine);(2S)-1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(2R)-1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(3R)-1-methyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(3S)-1-methyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;3-methyl-1-[3-[(2-methylpropan-2-yl)oxy]propyl]pyrrolidine;(3R)-3-methyl-1-[3-[(2-methylpropan-2-yl)oxy]propyl]pyrrolidine;(3S)-3-methyl-1-[3-[(2-methylpropan-2-yl)oxy]propyl]pyrrolidine;hexakis((2-methylpropan-2-yl)oxymethylcyclopentane) is CC(C)(C)OCC1CCCC1.CC(C)(C)OCC1CCCC1.CC(C)(C)OCC1CCCC1.CC(C)(C)OCC1CCCC1.CC(C)(C)OCC1CCCC1.CC(C)(C)OCC1CCCC1.CC1CCN(CCCOC(C)(C)C)C1.CCN1CCC(COC(C)(C)C)C1.CCN1CC[C@@H](COC(C)(C)C)C1.CCN1CC[C@H](COC(C)(C)C)C1.CN1CCC(COC(C)(C)C)C1.CN1CCC(COC(C)(C)C)C1.CN1CCCC1COC(C)(C)C.CN1CCCC1COC(C)(C)C.CN1CCC[C@@H]1COC(C)(C)C.CN1CCC[C@H]1COC(C)(C)C.CN1CC[C@@H](COC(C)(C)C)C1.CN1CC[C@H](COC(C)(C)C)C1.C[C@@H]1CCN(CCCOC(C)(C)C)C1.C[C@H]1CCN(CCCOC(C)(C)C)C1.
What is the InChIKey of 1-ethyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(3R)-1-ethyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(3S)-1-ethyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;bis(1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine);bis(1-methyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine);(2S)-1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(2R)-1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(3R)-1-methyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(3S)-1-methyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;3-methyl-1-[3-[(2-methylpropan-2-yl)oxy]propyl]pyrrolidine;(3R)-3-methyl-1-[3-[(2-methylpropan-2-yl)oxy]propyl]pyrrolidine;(3S)-3-methyl-1-[3-[(2-methylpropan-2-yl)oxy]propyl]pyrrolidine;hexakis((2-methylpropan-2-yl)oxymethylcyclopentane)?
The InChIKey is ICLBHZOMWAZYJX-LTEKQMGJSA-N. The full InChI is InChI=1S/3C12H25NO.3C11H23NO.8C10H21NO.6C10H20O/c3*1-11-6-8-13(10-11)7-5-9-14-12(2,3)4;3*1-5-12-7-6-10(8-12)9-13-11(2,3)4;4*1-10(2,3)12-8-9-5-6-11(4)7-9;4*1-10(2,3)12-8-9-6-5-7-11(9)4;6*1-10(2,3)11-8-9-6-4-5-7-9/h3*11H,5-10H2,1-4H3;3*10H,5-9H2,1-4H3;8*9H,5-8H2,1-4H3;6*9H,4-8H2,1-3H3/t2*11-;;2*10-;;2*9-;;;2*9-;;;;;;;;/m10.10.10..10......../s1.
What are the key properties of 1-ethyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(3R)-1-ethyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(3S)-1-ethyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;bis(1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine);bis(1-methyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine);(2S)-1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(2R)-1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(3R)-1-methyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(3S)-1-methyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;3-methyl-1-[3-[(2-methylpropan-2-yl)oxy]propyl]pyrrolidine;(3R)-3-methyl-1-[3-[(2-methylpropan-2-yl)oxy]propyl]pyrrolidine;(3S)-3-methyl-1-[3-[(2-methylpropan-2-yl)oxy]propyl]pyrrolidine;hexakis((2-methylpropan-2-yl)oxymethylcyclopentane)?
1-ethyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(3R)-1-ethyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(3S)-1-ethyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;bis(1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine);bis(1-methyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine);(2S)-1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(2R)-1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(3R)-1-methyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(3S)-1-methyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;3-methyl-1-[3-[(2-methylpropan-2-yl)oxy]propyl]pyrrolidine;(3R)-3-methyl-1-[3-[(2-methylpropan-2-yl)oxy]propyl]pyrrolidine;(3S)-3-methyl-1-[3-[(2-methylpropan-2-yl)oxy]propyl]pyrrolidine;hexakis((2-methylpropan-2-yl)oxymethylcyclopentane) has a molecular weight of 3461.83 g/mol, XLogP of 46.58, 49 rotatable bonds, 0 hydrogen bond donors, and 34 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(3R)-1-ethyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(3S)-1-ethyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;bis(1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine);bis(1-methyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine);(2S)-1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(2R)-1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(3R)-1-methyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;(3S)-1-methyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine;3-methyl-1-[3-[(2-methylpropan-2-yl)oxy]propyl]pyrrolidine;(3R)-3-methyl-1-[3-[(2-methylpropan-2-yl)oxy]propyl]pyrrolidine;(3S)-3-methyl-1-[3-[(2-methylpropan-2-yl)oxy]propyl]pyrrolidine;hexakis((2-methylpropan-2-yl)oxymethylcyclopentane) is sourced from PubChem (CID 158658379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).