1-[(3R)-3-hydroxypyrrolidin-1-yl]-2-methylpropan-1-one;1-[(3S)-3-hydroxypyrrolidin-1-yl]-2-methylpropan-1-one;3-methyl-3-(2-methylpropyl)oxetane;1-methyl-4-(2-methylpropyl)piperidine;(2R)-1-methyl-2-(2-methylpropyl)piperidine;(2S)-1-methyl-2-(2-methylpropyl)piperidine;1-methyl-3-(2-methylpropyl)pyrrolidine;(2S)-1-methyl-2-(2-methylpropyl)pyrrolidine;(2R)-1-methyl-2-(2-methylpropyl)pyrrolidine;2-methylpropylcyclopropane;(2R)-2-(2-methylpropyl)oxane;(2S)-2-(2-methylpropyl)oxane;4-(2-methylpropyl)oxane;3-(2-methylpropyl)oxetane;(2R)-2-(2-methylpropyl)oxolane;(2S)-2-(2-methylpropyl)oxolane;3-(2-methylpropyl)oxolane;(2R)-2-(2-methylpropyl)piperidine;(2S)-2-(2-methylpropyl)piperidine;4-(2-methylpropyl)piperidine;(2R)-2-(2-methylpropyl)pyrrolidine;(2S)-2-(2-methylpropyl)pyrrolidine;3-(2-methylpropyl)pyrrolidine

C197H404N14O12 — CID 158500410

IUPAC1-[(3R)-3-hydroxypyrrolidin-1-yl]-2-methylpropan-1-one;1-[(3S)-3-hydroxypyrrolidin-1-yl]-2-methylpropan-1-one;3-methyl-3-(2-methylpropyl)oxetane;1-methyl-4-(2-methylpropyl)piperidine;(2R)-1-methyl-2-(2-methylpropyl)piperidine;(2S)-1-methyl-2-(2-methylpropyl)piperidine;1-methyl-3-(2-methylpropyl)pyrrolidine;(2S)-1-methyl-2-(2-methylpropyl)pyrrolidine;(2R)-1-methyl-2-(2-methylpropyl)pyrrolidine;2-methylpropylcyclopropane;(2R)-2-(2-methylpropyl)oxane;(2S)-2-(2-methylpropyl)oxane;4-(2-methylpropyl)oxane;3-(2-methylpropyl)oxetane;(2R)-2-(2-methylpropyl)oxolane;(2S)-2-(2-methylpropyl)oxolane;3-(2-methylpropyl)oxolane;(2R)-2-(2-methylpropyl)piperidine;(2S)-2-(2-methylpropyl)piperidine;4-(2-methylpropyl)piperidine;(2R)-2-(2-methylpropyl)pyrrolidine;(2S)-2-(2-methylpropyl)pyrrolidine;3-(2-methylpropyl)pyrrolidine
SMILESCC(C)C(=O)N1CC[C@@H](O)C1.CC(C)C(=O)N1CC[C@H](O)C1.CC(C)CC1(C)COC1.CC(C)CC1CC1.CC(C)CC1CCN(C)C1.CC(C)CC1CCN(C)CC1.CC(C)CC1CCNC1.CC(C)CC1CCNCC1.CC(C)CC1CCOC1.CC(C)CC1CCOCC1.CC(C)CC1COC1.CC(C)C[C@@H]1CCCCN1.CC(C)C[C@@H]1CCCCN1C.CC(C)C[C@@H]1CCCCO1.CC(C)C[C@@H]1CCCN1.CC(C)C[C@@H]1CCCN1C.CC(C)C[C@@H]1CCCO1.CC(C)C[C@H]1CCCCN1.CC(C)C[C@H]1CCCCN1C.CC(C)C[C@H]1CCCCO1.CC(C)C[C@H]1CCCN1.CC(C)C[C@H]1CCCN1C.CC(C)C[C@H]1CCCO1
InChIInChI=1S/3C10H21N.6C9H19N.3C9H18O.2C8H15NO2.3C8H17N.4C8H16O.C7H14O.C7H14/c1-9(2)8-10-4-6-11(3)7-5-10;2*1-9(2)8-10-6-4-5-7-11(10)3;1-8(2)6-9-4-5-10(3)7-9;2*1-8(2)7-9-5-4-6-10(9)3;1-8(2)7-9-3-5-10-6-4-9;2*1-8(2)7-9-5-3-4-6-10-9;1-8(2)7-9-3-5-10-6-4-9;2*1-8(2)7-9-5-3-4-6-10-9;2*1-6(2)8(11)9-4-3-7(10)5-9;1-7(2)5-8-3-4-9-6-8;2*1-7(2)6-8-4-3-5-9-8;1-7(2)4-8(3)5-9-6-8;1-7(2)5-8-3-4-9-6-8;2*1-7(2)6-8-4-3-5-9-8;1-6(2)3-7-4-8-5-7;1-6(2)5-7-3-4-7/h3*9-10H,4-8H2,1-3H3;3*8-9H,4-7H2,1-3H3;3*8-10H,3-7H2,1-2H3;3*8-9H,3-7H2,1-2H3;2*6-7,10H,3-5H2,1-2H3;3*7-9H,3-6H2,1-2H3;7H,4-6H2,1-3H3;3*7-8H,3-6H2,1-2H3;6-7H,3-5H2,1-2H3;6-7H,3-5H2,1-2H3/t;2*10-;;2*9-;;2*9-;;2*9-;2*7-;;2*8-;;;2*8-;;/m.10.10.10.1010.10..10../s1
InChIKeyHJUYGRSJNVHVDE-QXJLPAOOSA-N
MW3161.48 g/mol
LogP46.05
Rot. Bonds44

About 1-[(3R)-3-hydroxypyrrolidin-1-yl]-2-methylpropan-1-one;1-[(3S)-3-hydroxypyrrolidin-1-yl]-2-methylpropan-1-one;3-methyl-3-(2-methylpropyl)oxetane;1-methyl-4-(2-methylpropyl)piperidine;(2R)-1-methyl-2-(2-methylpropyl)piperidine;(2S)-1-methyl-2-(2-methylpropyl)piperidine;1-methyl-3-(2-methylpropyl)pyrrolidine;(2S)-1-methyl-2-(2-methylpropyl)pyrrolidine;(2R)-1-methyl-2-(2-methylpropyl)pyrrolidine;2-methylpropylcyclopropane;(2R)-2-(2-methylpropyl)oxane;(2S)-2-(2-methylpropyl)oxane;4-(2-methylpropyl)oxane;3-(2-methylpropyl)oxetane;(2R)-2-(2-methylpropyl)oxolane;(2S)-2-(2-methylpropyl)oxolane;3-(2-methylpropyl)oxolane;(2R)-2-(2-methylpropyl)piperidine;(2S)-2-(2-methylpropyl)piperidine;4-(2-methylpropyl)piperidine;(2R)-2-(2-methylpropyl)pyrrolidine;(2S)-2-(2-methylpropyl)pyrrolidine;3-(2-methylpropyl)pyrrolidine

1-[(3R)-3-hydroxypyrrolidin-1-yl]-2-methylpropan-1-one;1-[(3S)-3-hydroxypyrrolidin-1-yl]-2-methylpropan-1-one;3-methyl-3-(2-methylpropyl)oxetane;1-methyl-4-(2-methylpropyl)piperidine;(2R)-1-methyl-2-(2-methylpropyl)piperidine;(2S)-1-methyl-2-(2-methylpropyl)piperidine;1-methyl-3-(2-methylpropyl)pyrrolidine;(2S)-1-methyl-2-(2-methylpropyl)pyrrolidine;(2R)-1-methyl-2-(2-methylpropyl)pyrrolidine;2-methylpropylcyclopropane;(2R)-2-(2-methylpropyl)oxane;(2S)-2-(2-methylpropyl)oxane;4-(2-methylpropyl)oxane;3-(2-methylpropyl)oxetane;(2R)-2-(2-methylpropyl)oxolane;(2S)-2-(2-methylpropyl)oxolane;3-(2-methylpropyl)oxolane;(2R)-2-(2-methylpropyl)piperidine;(2S)-2-(2-methylpropyl)piperidine;4-(2-methylpropyl)piperidine;(2R)-2-(2-methylpropyl)pyrrolidine;(2S)-2-(2-methylpropyl)pyrrolidine;3-(2-methylpropyl)pyrrolidine (PubChem CID 158500410) has the molecular formula C197H404N14O12 and a molecular weight of 3161.48 g/mol. Its IUPAC name is 1-[(3R)-3-hydroxypyrrolidin-1-yl]-2-methylpropan-1-one;1-[(3S)-3-hydroxypyrrolidin-1-yl]-2-methylpropan-1-one;3-methyl-3-(2-methylpropyl)oxetane;1-methyl-4-(2-methylpropyl)piperidine;(2R)-1-methyl-2-(2-methylpropyl)piperidine;(2S)-1-methyl-2-(2-methylpropyl)piperidine;1-methyl-3-(2-methylpropyl)pyrrolidine;(2S)-1-methyl-2-(2-methylpropyl)pyrrolidine;(2R)-1-methyl-2-(2-methylpropyl)pyrrolidine;2-methylpropylcyclopropane;(2R)-2-(2-methylpropyl)oxane;(2S)-2-(2-methylpropyl)oxane;4-(2-methylpropyl)oxane;3-(2-methylpropyl)oxetane;(2R)-2-(2-methylpropyl)oxolane;(2S)-2-(2-methylpropyl)oxolane;3-(2-methylpropyl)oxolane;(2R)-2-(2-methylpropyl)piperidine;(2S)-2-(2-methylpropyl)piperidine;4-(2-methylpropyl)piperidine;(2R)-2-(2-methylpropyl)pyrrolidine;(2S)-2-(2-methylpropyl)pyrrolidine;3-(2-methylpropyl)pyrrolidine.

Molecular Properties

Compound Name1-[(3R)-3-hydroxypyrrolidin-1-yl]-2-methylpropan-1-one;1-[(3S)-3-hydroxypyrrolidin-1-yl]-2-methylpropan-1-one;3-methyl-3-(2-methylpropyl)oxetane;1-methyl-4-(2-methylpropyl)piperidine;(2R)-1-methyl-2-(2-methylpropyl)piperidine;(2S)-1-methyl-2-(2-methylpropyl)piperidine;1-methyl-3-(2-methylpropyl)pyrrolidine;(2S)-1-methyl-2-(2-methylpropyl)pyrrolidine;(2R)-1-methyl-2-(2-methylpropyl)pyrrolidine;2-methylpropylcyclopropane;(2R)-2-(2-methylpropyl)oxane;(2S)-2-(2-methylpropyl)oxane;4-(2-methylpropyl)oxane;3-(2-methylpropyl)oxetane;(2R)-2-(2-methylpropyl)oxolane;(2S)-2-(2-methylpropyl)oxolane;3-(2-methylpropyl)oxolane;(2R)-2-(2-methylpropyl)piperidine;(2S)-2-(2-methylpropyl)piperidine;4-(2-methylpropyl)piperidine;(2R)-2-(2-methylpropyl)pyrrolidine;(2S)-2-(2-methylpropyl)pyrrolidine;3-(2-methylpropyl)pyrrolidine
PubChem CID158500410
Molecular FormulaC197H404N14O12
Molecular Weight3161.48 g/mol
Exact Mass3159.14
IUPAC Name1-[(3R)-3-hydroxypyrrolidin-1-yl]-2-methylpropan-1-one;1-[(3S)-3-hydroxypyrrolidin-1-yl]-2-methylpropan-1-one;3-methyl-3-(2-methylpropyl)oxetane;1-methyl-4-(2-methylpropyl)piperidine;(2R)-1-methyl-2-(2-methylpropyl)piperidine;(2S)-1-methyl-2-(2-methylpropyl)piperidine;1-methyl-3-(2-methylpropyl)pyrrolidine;(2S)-1-methyl-2-(2-methylpropyl)pyrrolidine;(2R)-1-methyl-2-(2-methylpropyl)pyrrolidine;2-methylpropylcyclopropane;(2R)-2-(2-methylpropyl)oxane;(2S)-2-(2-methylpropyl)oxane;4-(2-methylpropyl)oxane;3-(2-methylpropyl)oxetane;(2R)-2-(2-methylpropyl)oxolane;(2S)-2-(2-methylpropyl)oxolane;3-(2-methylpropyl)oxolane;(2R)-2-(2-methylpropyl)piperidine;(2S)-2-(2-methylpropyl)piperidine;4-(2-methylpropyl)piperidine;(2R)-2-(2-methylpropyl)pyrrolidine;(2S)-2-(2-methylpropyl)pyrrolidine;3-(2-methylpropyl)pyrrolidine
SMILESCC(C)C(=O)N1CC[C@@H](O)C1.CC(C)C(=O)N1CC[C@H](O)C1.CC(C)CC1(C)COC1.CC(C)CC1CC1.CC(C)CC1CCN(C)C1.CC(C)CC1CCN(C)CC1.CC(C)CC1CCNC1.CC(C)CC1CCNCC1.CC(C)CC1CCOC1.CC(C)CC1CCOCC1.CC(C)CC1COC1.CC(C)C[C@@H]1CCCCN1.CC(C)C[C@@H]1CCCCN1C.CC(C)C[C@@H]1CCCCO1.CC(C)C[C@@H]1CCCN1.CC(C)C[C@@H]1CCCN1C.CC(C)C[C@@H]1CCCO1.CC(C)C[C@H]1CCCCN1.CC(C)C[C@H]1CCCCN1C.CC(C)C[C@H]1CCCCO1.CC(C)C[C@H]1CCCN1.CC(C)C[C@H]1CCCN1C.CC(C)C[C@H]1CCCO1
InChIInChI=1S/3C10H21N.6C9H19N.3C9H18O.2C8H15NO2.3C8H17N.4C8H16O.C7H14O.C7H14/c1-9(2)8-10-4-6-11(3)7-5-10;2*1-9(2)8-10-6-4-5-7-11(10)3;1-8(2)6-9-4-5-10(3)7-9;2*1-8(2)7-9-5-4-6-10(9)3;1-8(2)7-9-3-5-10-6-4-9;2*1-8(2)7-9-5-3-4-6-10-9;1-8(2)7-9-3-5-10-6-4-9;2*1-8(2)7-9-5-3-4-6-10-9;2*1-6(2)8(11)9-4-3-7(10)5-9;1-7(2)5-8-3-4-9-6-8;2*1-7(2)6-8-4-3-5-9-8;1-7(2)4-8(3)5-9-6-8;1-7(2)5-8-3-4-9-6-8;2*1-7(2)6-8-4-3-5-9-8;1-6(2)3-7-4-8-5-7;1-6(2)5-7-3-4-7/h3*9-10H,4-8H2,1-3H3;3*8-9H,4-7H2,1-3H3;3*8-10H,3-7H2,1-2H3;3*8-9H,3-7H2,1-2H3;2*6-7,10H,3-5H2,1-2H3;3*7-9H,3-6H2,1-2H3;7H,4-6H2,1-3H3;3*7-8H,3-6H2,1-2H3;6-7H,3-5H2,1-2H3;6-7H,3-5H2,1-2H3/t;2*10-;;2*9-;;2*9-;;2*9-;2*7-;;2*8-;;;2*8-;;/m.10.10.10.1010.10..10../s1
InChIKeyHJUYGRSJNVHVDE-QXJLPAOOSA-N
XLogP46.05
TPSA246.54 Ų
H-Bond Donors8
H-Bond Acceptors24
Rotatable Bonds44
Heavy Atoms223
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003161.48
LogP ≤ 546.05
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1024

Analyze 1-[(3R)-3-hydroxypyrrolidin-1-yl]-2-methylpropan-1-one;1-[(3S)-3-hydroxypyrrolidin-1-yl]-2-methylpropan-1-one;3-methyl-3-(2-methylpropyl)oxetane;1-methyl-4-(2-methylpropyl)piperidine;(2R)-1-methyl-2-(2-methylpropyl)piperidine;(2S)-1-methyl-2-(2-methylpropyl)piperidine;1-methyl-3-(2-methylpropyl)pyrrolidine;(2S)-1-methyl-2-(2-methylpropyl)pyrrolidine;(2R)-1-methyl-2-(2-methylpropyl)pyrrolidine;2-methylpropylcyclopropane;(2R)-2-(2-methylpropyl)oxane;(2S)-2-(2-methylpropyl)oxane;4-(2-methylpropyl)oxane;3-(2-methylpropyl)oxetane;(2R)-2-(2-methylpropyl)oxolane;(2S)-2-(2-methylpropyl)oxolane;3-(2-methylpropyl)oxolane;(2R)-2-(2-methylpropyl)piperidine;(2S)-2-(2-methylpropyl)piperidine;4-(2-methylpropyl)piperidine;(2R)-2-(2-methylpropyl)pyrrolidine;(2S)-2-(2-methylpropyl)pyrrolidine;3-(2-methylpropyl)pyrrolidine with MolForge

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Related Compounds

(3S)-1-ethyl-3-(2-methylpropyl)piperidine;1-fluoro-1-(2-methylpropyl)cyclohexane;3-(3-methylbutan-2-yl)pyrrolidine;(2R)-2-(3-methylbutyl)pyrrolidine;1-methyl-3-(2-methylpropyl)piperidine;(3R)-1-methyl-3-(2-methylpropyl)piperidine;(3S)-1-methyl-3-(2-methylpropyl)piperidine;1-methyl-3-(2-methylpropyl)pyrrolidine;(3R)-1-methyl-3-(2-methylpropyl)pyrrolidine;(3S)-1-methyl-3-(2-methylpropyl)pyrrolidine;2-methylpropylcyclobutane;tris(2-methylpropylcyclohexane);1-(2-methylpropyl)cyclohexan-1-ol;tris(2-methylpropylcyclopentane);2-(2-methylpropyl)oxane;4-(2-methylpropyl)oxane;4-(2-methylpropyl)piperidine;(3S)-3-(2-methylpropyl)-1-propylpiperidine
CID 162088911
1-methyl-4-(2-methylpropyl)piperidine;tetrakis(2-methylpropylcyclohexane);1-[4-(2-methylpropyl)cyclohexyl]piperidine;2-(2-methylpropyl)-1,4-dioxane;(2S)-2-(2-methylpropyl)-1,4-dioxane;(2R)-2-(2-methylpropyl)-1,4-dioxane;(3S)-3-(2-methylpropyl)oxane;3-(2-methylpropyl)oxetane;4-(2-methylpropyl)-1-(oxetan-3-yl)piperidine
CID 165078755
3-(2-methylpropyl)-1-(oxan-2-ylmethyl)piperazine
CID 64834625
1-cyclopropyl-2-(2-methylpropyl)pyrrolidine;(2R)-4-fluoro-1,4-dimethyl-2-(2-methylpropyl)pyrrolidine;1-(2-fluoroethyl)-2-(2-methylpropyl)pyrrolidine;1-(3-methylbutyl)pyrrolidine;1-(3-methylbutyl)pyrrolidin-2-one;1-methylidene-3-(2-methylpropyl)cyclopentane;(3R)-1-methylidene-3-(2-methylpropyl)cyclopentane;(3S)-1-methylidene-3-(2-methylpropyl)cyclopentane;1-methyl-2-methylidene-5-(2-methylpropyl)pyrrolidine;(5S)-1-methyl-2-methylidene-5-(2-methylpropyl)pyrrolidine;(5R)-1-methyl-2-methylidene-5-(2-methylpropyl)pyrrolidine;1-methyl-2-(2-methylpropyl)pyrrolidine;(2S)-1-methyl-2-(2-methylpropyl)pyrrolidine;(2R)-1-methyl-2-(2-methylpropyl)pyrrolidine;2-methylpropylcyclohexane;hexakis(2-methylpropylcyclopentane);2-(2-methylpropyl)oxane;(5R)-5-(2-methylpropyl)oxolan-2-one;2-(2-methylpropyl)piperidine;2-(2-methylpropyl)-1-propan-2-ylpyrrolidine
CID 159369792
methane;1-methyl-3-propan-2-ylpiperidine;1-methyl-4-propan-2-ylpiperidine;1-methyl-3-propan-2-ylpyrrolidine;propan-2-ylcyclohexane;bis(propan-2-ylcyclopentane);4-propan-2-yloxane;3-propan-2-ylpiperidine;4-propan-2-ylpiperidine
CID 159345239
2-amino-1-[3-(2-methylpropyl)piperidin-1-yl]-2-(oxan-4-yl)ethanone
CID 120795292
2-aminoethanol;2-aminopropan-1-ol;3-aminopropan-1-ol;N-cyclohexylhydroxylamine;2-hydrazinylethanol;1-methylpiperidin-3-ol;(1-methylpiperidin-2-yl)methanol;2-morpholin-4-ylethanol;3-morpholin-4-ylpropane-1,2-diol;piperidin-3-ol;2-piperidin-1-ylethanol;piperidin-2-ylmethanol;3-piperidin-1-ylpropane-1,2-diol;N-propan-2-ylhydroxylamine
CID 159010819
2-(1,1-dioxo-1,4-thiazinan-4-yl)ethyl 2,2,2-triiodoacetate;2-(4-methylpiperazin-1-yl)ethyl 2,2,2-triiodoacetate;(1-methylpiperidin-3-yl)methyl 2-iodopropanoate;(1-methylpiperidin-4-yl)methyl 2-iodopropanoate;2-(1-methylpyrrolidin-2-yl)ethyl 2-iodopropanoate;2-morpholin-4-ylethyl 2,2,2-triiodoacetate;2-piperazin-1-ylethyl 2,2,2-triiodoacetate;2-piperidin-1-ylethyl 2-iodopropanoate;2-piperidin-2-ylethyl 2-iodopropanoate;2-piperidin-4-ylethyl 2-iodopropanoate;2-piperidin-1-ylethyl 2,2,2-triiodoacetate;piperidin-4-ylmethyl 2-iodopropanoate
CID 163503952
3-(2-methylpropyl)-1-(oxan-3-ylmethyl)-1,4-diazepane
CID 64950927
[3-(2-methylpropyl)piperidin-1-yl]-piperidin-2-ylmethanone
CID 119337354
1-methyl-2-(2-methylpropyl)azepane
CID 130636029
(2R)-2-(2-methylpropyl)oxane
CID 58653197

Frequently Asked Questions

What is the IUPAC name of 1-[(3R)-3-hydroxypyrrolidin-1-yl]-2-methylpropan-1-one;1-[(3S)-3-hydroxypyrrolidin-1-yl]-2-methylpropan-1-one;3-methyl-3-(2-methylpropyl)oxetane;1-methyl-4-(2-methylpropyl)piperidine;(2R)-1-methyl-2-(2-methylpropyl)piperidine;(2S)-1-methyl-2-(2-methylpropyl)piperidine;1-methyl-3-(2-methylpropyl)pyrrolidine;(2S)-1-methyl-2-(2-methylpropyl)pyrrolidine;(2R)-1-methyl-2-(2-methylpropyl)pyrrolidine;2-methylpropylcyclopropane;(2R)-2-(2-methylpropyl)oxane;(2S)-2-(2-methylpropyl)oxane;4-(2-methylpropyl)oxane;3-(2-methylpropyl)oxetane;(2R)-2-(2-methylpropyl)oxolane;(2S)-2-(2-methylpropyl)oxolane;3-(2-methylpropyl)oxolane;(2R)-2-(2-methylpropyl)piperidine;(2S)-2-(2-methylpropyl)piperidine;4-(2-methylpropyl)piperidine;(2R)-2-(2-methylpropyl)pyrrolidine;(2S)-2-(2-methylpropyl)pyrrolidine;3-(2-methylpropyl)pyrrolidine?
The IUPAC name of 1-[(3R)-3-hydroxypyrrolidin-1-yl]-2-methylpropan-1-one;1-[(3S)-3-hydroxypyrrolidin-1-yl]-2-methylpropan-1-one;3-methyl-3-(2-methylpropyl)oxetane;1-methyl-4-(2-methylpropyl)piperidine;(2R)-1-methyl-2-(2-methylpropyl)piperidine;(2S)-1-methyl-2-(2-methylpropyl)piperidine;1-methyl-3-(2-methylpropyl)pyrrolidine;(2S)-1-methyl-2-(2-methylpropyl)pyrrolidine;(2R)-1-methyl-2-(2-methylpropyl)pyrrolidine;2-methylpropylcyclopropane;(2R)-2-(2-methylpropyl)oxane;(2S)-2-(2-methylpropyl)oxane;4-(2-methylpropyl)oxane;3-(2-methylpropyl)oxetane;(2R)-2-(2-methylpropyl)oxolane;(2S)-2-(2-methylpropyl)oxolane;3-(2-methylpropyl)oxolane;(2R)-2-(2-methylpropyl)piperidine;(2S)-2-(2-methylpropyl)piperidine;4-(2-methylpropyl)piperidine;(2R)-2-(2-methylpropyl)pyrrolidine;(2S)-2-(2-methylpropyl)pyrrolidine;3-(2-methylpropyl)pyrrolidine (CID 158500410) is 1-[(3R)-3-hydroxypyrrolidin-1-yl]-2-methylpropan-1-one;1-[(3S)-3-hydroxypyrrolidin-1-yl]-2-methylpropan-1-one;3-methyl-3-(2-methylpropyl)oxetane;1-methyl-4-(2-methylpropyl)piperidine;(2R)-1-methyl-2-(2-methylpropyl)piperidine;(2S)-1-methyl-2-(2-methylpropyl)piperidine;1-methyl-3-(2-methylpropyl)pyrrolidine;(2S)-1-methyl-2-(2-methylpropyl)pyrrolidine;(2R)-1-methyl-2-(2-methylpropyl)pyrrolidine;2-methylpropylcyclopropane;(2R)-2-(2-methylpropyl)oxane;(2S)-2-(2-methylpropyl)oxane;4-(2-methylpropyl)oxane;3-(2-methylpropyl)oxetane;(2R)-2-(2-methylpropyl)oxolane;(2S)-2-(2-methylpropyl)oxolane;3-(2-methylpropyl)oxolane;(2R)-2-(2-methylpropyl)piperidine;(2S)-2-(2-methylpropyl)piperidine;4-(2-methylpropyl)piperidine;(2R)-2-(2-methylpropyl)pyrrolidine;(2S)-2-(2-methylpropyl)pyrrolidine;3-(2-methylpropyl)pyrrolidine.
What is the SMILES notation for 1-[(3R)-3-hydroxypyrrolidin-1-yl]-2-methylpropan-1-one;1-[(3S)-3-hydroxypyrrolidin-1-yl]-2-methylpropan-1-one;3-methyl-3-(2-methylpropyl)oxetane;1-methyl-4-(2-methylpropyl)piperidine;(2R)-1-methyl-2-(2-methylpropyl)piperidine;(2S)-1-methyl-2-(2-methylpropyl)piperidine;1-methyl-3-(2-methylpropyl)pyrrolidine;(2S)-1-methyl-2-(2-methylpropyl)pyrrolidine;(2R)-1-methyl-2-(2-methylpropyl)pyrrolidine;2-methylpropylcyclopropane;(2R)-2-(2-methylpropyl)oxane;(2S)-2-(2-methylpropyl)oxane;4-(2-methylpropyl)oxane;3-(2-methylpropyl)oxetane;(2R)-2-(2-methylpropyl)oxolane;(2S)-2-(2-methylpropyl)oxolane;3-(2-methylpropyl)oxolane;(2R)-2-(2-methylpropyl)piperidine;(2S)-2-(2-methylpropyl)piperidine;4-(2-methylpropyl)piperidine;(2R)-2-(2-methylpropyl)pyrrolidine;(2S)-2-(2-methylpropyl)pyrrolidine;3-(2-methylpropyl)pyrrolidine?
The canonical SMILES for 1-[(3R)-3-hydroxypyrrolidin-1-yl]-2-methylpropan-1-one;1-[(3S)-3-hydroxypyrrolidin-1-yl]-2-methylpropan-1-one;3-methyl-3-(2-methylpropyl)oxetane;1-methyl-4-(2-methylpropyl)piperidine;(2R)-1-methyl-2-(2-methylpropyl)piperidine;(2S)-1-methyl-2-(2-methylpropyl)piperidine;1-methyl-3-(2-methylpropyl)pyrrolidine;(2S)-1-methyl-2-(2-methylpropyl)pyrrolidine;(2R)-1-methyl-2-(2-methylpropyl)pyrrolidine;2-methylpropylcyclopropane;(2R)-2-(2-methylpropyl)oxane;(2S)-2-(2-methylpropyl)oxane;4-(2-methylpropyl)oxane;3-(2-methylpropyl)oxetane;(2R)-2-(2-methylpropyl)oxolane;(2S)-2-(2-methylpropyl)oxolane;3-(2-methylpropyl)oxolane;(2R)-2-(2-methylpropyl)piperidine;(2S)-2-(2-methylpropyl)piperidine;4-(2-methylpropyl)piperidine;(2R)-2-(2-methylpropyl)pyrrolidine;(2S)-2-(2-methylpropyl)pyrrolidine;3-(2-methylpropyl)pyrrolidine is CC(C)C(=O)N1CC[C@@H](O)C1.CC(C)C(=O)N1CC[C@H](O)C1.CC(C)CC1(C)COC1.CC(C)CC1CC1.CC(C)CC1CCN(C)C1.CC(C)CC1CCN(C)CC1.CC(C)CC1CCNC1.CC(C)CC1CCNCC1.CC(C)CC1CCOC1.CC(C)CC1CCOCC1.CC(C)CC1COC1.CC(C)C[C@@H]1CCCCN1.CC(C)C[C@@H]1CCCCN1C.CC(C)C[C@@H]1CCCCO1.CC(C)C[C@@H]1CCCN1.CC(C)C[C@@H]1CCCN1C.CC(C)C[C@@H]1CCCO1.CC(C)C[C@H]1CCCCN1.CC(C)C[C@H]1CCCCN1C.CC(C)C[C@H]1CCCCO1.CC(C)C[C@H]1CCCN1.CC(C)C[C@H]1CCCN1C.CC(C)C[C@H]1CCCO1.
What is the InChIKey of 1-[(3R)-3-hydroxypyrrolidin-1-yl]-2-methylpropan-1-one;1-[(3S)-3-hydroxypyrrolidin-1-yl]-2-methylpropan-1-one;3-methyl-3-(2-methylpropyl)oxetane;1-methyl-4-(2-methylpropyl)piperidine;(2R)-1-methyl-2-(2-methylpropyl)piperidine;(2S)-1-methyl-2-(2-methylpropyl)piperidine;1-methyl-3-(2-methylpropyl)pyrrolidine;(2S)-1-methyl-2-(2-methylpropyl)pyrrolidine;(2R)-1-methyl-2-(2-methylpropyl)pyrrolidine;2-methylpropylcyclopropane;(2R)-2-(2-methylpropyl)oxane;(2S)-2-(2-methylpropyl)oxane;4-(2-methylpropyl)oxane;3-(2-methylpropyl)oxetane;(2R)-2-(2-methylpropyl)oxolane;(2S)-2-(2-methylpropyl)oxolane;3-(2-methylpropyl)oxolane;(2R)-2-(2-methylpropyl)piperidine;(2S)-2-(2-methylpropyl)piperidine;4-(2-methylpropyl)piperidine;(2R)-2-(2-methylpropyl)pyrrolidine;(2S)-2-(2-methylpropyl)pyrrolidine;3-(2-methylpropyl)pyrrolidine?
The InChIKey is HJUYGRSJNVHVDE-QXJLPAOOSA-N. The full InChI is InChI=1S/3C10H21N.6C9H19N.3C9H18O.2C8H15NO2.3C8H17N.4C8H16O.C7H14O.C7H14/c1-9(2)8-10-4-6-11(3)7-5-10;2*1-9(2)8-10-6-4-5-7-11(10)3;1-8(2)6-9-4-5-10(3)7-9;2*1-8(2)7-9-5-4-6-10(9)3;1-8(2)7-9-3-5-10-6-4-9;2*1-8(2)7-9-5-3-4-6-10-9;1-8(2)7-9-3-5-10-6-4-9;2*1-8(2)7-9-5-3-4-6-10-9;2*1-6(2)8(11)9-4-3-7(10)5-9;1-7(2)5-8-3-4-9-6-8;2*1-7(2)6-8-4-3-5-9-8;1-7(2)4-8(3)5-9-6-8;1-7(2)5-8-3-4-9-6-8;2*1-7(2)6-8-4-3-5-9-8;1-6(2)3-7-4-8-5-7;1-6(2)5-7-3-4-7/h3*9-10H,4-8H2,1-3H3;3*8-9H,4-7H2,1-3H3;3*8-10H,3-7H2,1-2H3;3*8-9H,3-7H2,1-2H3;2*6-7,10H,3-5H2,1-2H3;3*7-9H,3-6H2,1-2H3;7H,4-6H2,1-3H3;3*7-8H,3-6H2,1-2H3;6-7H,3-5H2,1-2H3;6-7H,3-5H2,1-2H3/t;2*10-;;2*9-;;2*9-;;2*9-;2*7-;;2*8-;;;2*8-;;/m.10.10.10.1010.10..10../s1.
What are the key properties of 1-[(3R)-3-hydroxypyrrolidin-1-yl]-2-methylpropan-1-one;1-[(3S)-3-hydroxypyrrolidin-1-yl]-2-methylpropan-1-one;3-methyl-3-(2-methylpropyl)oxetane;1-methyl-4-(2-methylpropyl)piperidine;(2R)-1-methyl-2-(2-methylpropyl)piperidine;(2S)-1-methyl-2-(2-methylpropyl)piperidine;1-methyl-3-(2-methylpropyl)pyrrolidine;(2S)-1-methyl-2-(2-methylpropyl)pyrrolidine;(2R)-1-methyl-2-(2-methylpropyl)pyrrolidine;2-methylpropylcyclopropane;(2R)-2-(2-methylpropyl)oxane;(2S)-2-(2-methylpropyl)oxane;4-(2-methylpropyl)oxane;3-(2-methylpropyl)oxetane;(2R)-2-(2-methylpropyl)oxolane;(2S)-2-(2-methylpropyl)oxolane;3-(2-methylpropyl)oxolane;(2R)-2-(2-methylpropyl)piperidine;(2S)-2-(2-methylpropyl)piperidine;4-(2-methylpropyl)piperidine;(2R)-2-(2-methylpropyl)pyrrolidine;(2S)-2-(2-methylpropyl)pyrrolidine;3-(2-methylpropyl)pyrrolidine?
1-[(3R)-3-hydroxypyrrolidin-1-yl]-2-methylpropan-1-one;1-[(3S)-3-hydroxypyrrolidin-1-yl]-2-methylpropan-1-one;3-methyl-3-(2-methylpropyl)oxetane;1-methyl-4-(2-methylpropyl)piperidine;(2R)-1-methyl-2-(2-methylpropyl)piperidine;(2S)-1-methyl-2-(2-methylpropyl)piperidine;1-methyl-3-(2-methylpropyl)pyrrolidine;(2S)-1-methyl-2-(2-methylpropyl)pyrrolidine;(2R)-1-methyl-2-(2-methylpropyl)pyrrolidine;2-methylpropylcyclopropane;(2R)-2-(2-methylpropyl)oxane;(2S)-2-(2-methylpropyl)oxane;4-(2-methylpropyl)oxane;3-(2-methylpropyl)oxetane;(2R)-2-(2-methylpropyl)oxolane;(2S)-2-(2-methylpropyl)oxolane;3-(2-methylpropyl)oxolane;(2R)-2-(2-methylpropyl)piperidine;(2S)-2-(2-methylpropyl)piperidine;4-(2-methylpropyl)piperidine;(2R)-2-(2-methylpropyl)pyrrolidine;(2S)-2-(2-methylpropyl)pyrrolidine;3-(2-methylpropyl)pyrrolidine has a molecular weight of 3161.48 g/mol, XLogP of 46.05, 44 rotatable bonds, 8 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3R)-3-hydroxypyrrolidin-1-yl]-2-methylpropan-1-one;1-[(3S)-3-hydroxypyrrolidin-1-yl]-2-methylpropan-1-one;3-methyl-3-(2-methylpropyl)oxetane;1-methyl-4-(2-methylpropyl)piperidine;(2R)-1-methyl-2-(2-methylpropyl)piperidine;(2S)-1-methyl-2-(2-methylpropyl)piperidine;1-methyl-3-(2-methylpropyl)pyrrolidine;(2S)-1-methyl-2-(2-methylpropyl)pyrrolidine;(2R)-1-methyl-2-(2-methylpropyl)pyrrolidine;2-methylpropylcyclopropane;(2R)-2-(2-methylpropyl)oxane;(2S)-2-(2-methylpropyl)oxane;4-(2-methylpropyl)oxane;3-(2-methylpropyl)oxetane;(2R)-2-(2-methylpropyl)oxolane;(2S)-2-(2-methylpropyl)oxolane;3-(2-methylpropyl)oxolane;(2R)-2-(2-methylpropyl)piperidine;(2S)-2-(2-methylpropyl)piperidine;4-(2-methylpropyl)piperidine;(2R)-2-(2-methylpropyl)pyrrolidine;(2S)-2-(2-methylpropyl)pyrrolidine;3-(2-methylpropyl)pyrrolidine is sourced from PubChem (CID 158500410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).