4-(4-tert-butylphenoxy)-1-methylpiperidine;4-(4-tert-butylphenoxy)-1-methylsulfonylpiperidine;4-(4-tert-butylphenoxy)piperidine;1-[4-(4-tert-butylphenoxy)piperidin-1-yl]ethanone;4-(4-tert-butylphenoxy)-1-propan-2-ylpiperidine;1-[4-[(3-tert-butylphenyl)methyl]piperazin-1-yl]ethanone;4-[(3-tert-butylphenyl)methyl]-1-propan-2-ylpiperidine;3-[(3-tert-butylphenyl)methyl]-1-propan-2-ylpyrrolidine;3-[(3-tert-butylphenyl)methyl]-1-(2,2,2-trifluoroethyl)pyrrolidine

C153H237F3N10O9S — CID 159009023

IUPAC4-(4-tert-butylphenoxy)-1-methylpiperidine;4-(4-tert-butylphenoxy)-1-methylsulfonylpiperidine;4-(4-tert-butylphenoxy)piperidine;1-[4-(4-tert-butylphenoxy)piperidin-1-yl]ethanone;4-(4-tert-butylphenoxy)-1-propan-2-ylpiperidine;1-[4-[(3-tert-butylphenyl)methyl]piperazin-1-yl]ethanone;4-[(3-tert-butylphenyl)methyl]-1-propan-2-ylpiperidine;3-[(3-tert-butylphenyl)methyl]-1-propan-2-ylpyrrolidine;3-[(3-tert-butylphenyl)methyl]-1-(2,2,2-trifluoroethyl)pyrrolidine
SMILESCC(=O)N1CCC(Oc2ccc(C(C)(C)C)cc2)CC1.CC(=O)N1CCN(Cc2cccc(C(C)(C)C)c2)CC1.CC(C)(C)c1ccc(OC2CCN(S(C)(=O)=O)CC2)cc1.CC(C)(C)c1ccc(OC2CCNCC2)cc1.CC(C)(C)c1cccc(CC2CCN(CC(F)(F)F)C2)c1.CC(C)N1CCC(Cc2cccc(C(C)(C)C)c2)C1.CC(C)N1CCC(Cc2cccc(C(C)(C)C)c2)CC1.CC(C)N1CCC(Oc2ccc(C(C)(C)C)cc2)CC1.CN1CCC(Oc2ccc(C(C)(C)C)cc2)CC1
InChIInChI=1S/C19H31N.C18H29NO.C18H29N.C17H24F3N.C17H26N2O.C17H25NO2.C16H25NO3S.C16H25NO.C15H23NO/c1-15(2)20-11-9-16(10-12-20)13-17-7-6-8-18(14-17)19(3,4)5;1-14(2)19-12-10-17(11-13-19)20-16-8-6-15(7-9-16)18(3,4)5;1-14(2)19-10-9-16(13-19)11-15-7-6-8-17(12-15)18(3,4)5;1-16(2,3)15-6-4-5-13(10-15)9-14-7-8-21(11-14)12-17(18,19)20;1-14(20)19-10-8-18(9-11-19)13-15-6-5-7-16(12-15)17(2,3)4;1-13(19)18-11-9-16(10-12-18)20-15-7-5-14(6-8-15)17(2,3)4;1-16(2,3)13-5-7-14(8-6-13)20-15-9-11-17(12-10-15)21(4,18)19;1-16(2,3)13-5-7-14(8-6-13)18-15-9-11-17(4)12-10-15;1-15(2,3)12-4-6-13(7-5-12)17-14-8-10-16-11-9-14/h6-8,14-16H,9-13H2,1-5H3;6-9,14,17H,10-13H2,1-5H3;6-8,12,14,16H,9-11,13H2,1-5H3;4-6,10,14H,7-9,11-12H2,1-3H3;5-7,12H,8-11,13H2,1-4H3;5-8,16H,9-12H2,1-4H3;5-8,15H,9-12H2,1-4H3;5-8,15H,9-12H2,1-4H3;4-7,14,16H,8-11H2,1-3H3
InChIKeyJSGXIQGKFJNBFT-UHFFFAOYSA-N
MW2449.70 g/mol
LogP32.93
Rot. Bonds23

About 4-(4-tert-butylphenoxy)-1-methylpiperidine;4-(4-tert-butylphenoxy)-1-methylsulfonylpiperidine;4-(4-tert-butylphenoxy)piperidine;1-[4-(4-tert-butylphenoxy)piperidin-1-yl]ethanone;4-(4-tert-butylphenoxy)-1-propan-2-ylpiperidine;1-[4-[(3-tert-butylphenyl)methyl]piperazin-1-yl]ethanone;4-[(3-tert-butylphenyl)methyl]-1-propan-2-ylpiperidine;3-[(3-tert-butylphenyl)methyl]-1-propan-2-ylpyrrolidine;3-[(3-tert-butylphenyl)methyl]-1-(2,2,2-trifluoroethyl)pyrrolidine

4-(4-tert-butylphenoxy)-1-methylpiperidine;4-(4-tert-butylphenoxy)-1-methylsulfonylpiperidine;4-(4-tert-butylphenoxy)piperidine;1-[4-(4-tert-butylphenoxy)piperidin-1-yl]ethanone;4-(4-tert-butylphenoxy)-1-propan-2-ylpiperidine;1-[4-[(3-tert-butylphenyl)methyl]piperazin-1-yl]ethanone;4-[(3-tert-butylphenyl)methyl]-1-propan-2-ylpiperidine;3-[(3-tert-butylphenyl)methyl]-1-propan-2-ylpyrrolidine;3-[(3-tert-butylphenyl)methyl]-1-(2,2,2-trifluoroethyl)pyrrolidine (PubChem CID 159009023) has the molecular formula C153H237F3N10O9S and a molecular weight of 2449.70 g/mol. Its IUPAC name is 4-(4-tert-butylphenoxy)-1-methylpiperidine;4-(4-tert-butylphenoxy)-1-methylsulfonylpiperidine;4-(4-tert-butylphenoxy)piperidine;1-[4-(4-tert-butylphenoxy)piperidin-1-yl]ethanone;4-(4-tert-butylphenoxy)-1-propan-2-ylpiperidine;1-[4-[(3-tert-butylphenyl)methyl]piperazin-1-yl]ethanone;4-[(3-tert-butylphenyl)methyl]-1-propan-2-ylpiperidine;3-[(3-tert-butylphenyl)methyl]-1-propan-2-ylpyrrolidine;3-[(3-tert-butylphenyl)methyl]-1-(2,2,2-trifluoroethyl)pyrrolidine.

Molecular Properties

Compound Name4-(4-tert-butylphenoxy)-1-methylpiperidine;4-(4-tert-butylphenoxy)-1-methylsulfonylpiperidine;4-(4-tert-butylphenoxy)piperidine;1-[4-(4-tert-butylphenoxy)piperidin-1-yl]ethanone;4-(4-tert-butylphenoxy)-1-propan-2-ylpiperidine;1-[4-[(3-tert-butylphenyl)methyl]piperazin-1-yl]ethanone;4-[(3-tert-butylphenyl)methyl]-1-propan-2-ylpiperidine;3-[(3-tert-butylphenyl)methyl]-1-propan-2-ylpyrrolidine;3-[(3-tert-butylphenyl)methyl]-1-(2,2,2-trifluoroethyl)pyrrolidine
PubChem CID159009023
Molecular FormulaC153H237F3N10O9S
Molecular Weight2449.70 g/mol
Exact Mass2447.81
IUPAC Name4-(4-tert-butylphenoxy)-1-methylpiperidine;4-(4-tert-butylphenoxy)-1-methylsulfonylpiperidine;4-(4-tert-butylphenoxy)piperidine;1-[4-(4-tert-butylphenoxy)piperidin-1-yl]ethanone;4-(4-tert-butylphenoxy)-1-propan-2-ylpiperidine;1-[4-[(3-tert-butylphenyl)methyl]piperazin-1-yl]ethanone;4-[(3-tert-butylphenyl)methyl]-1-propan-2-ylpiperidine;3-[(3-tert-butylphenyl)methyl]-1-propan-2-ylpyrrolidine;3-[(3-tert-butylphenyl)methyl]-1-(2,2,2-trifluoroethyl)pyrrolidine
SMILESCC(=O)N1CCC(Oc2ccc(C(C)(C)C)cc2)CC1.CC(=O)N1CCN(Cc2cccc(C(C)(C)C)c2)CC1.CC(C)(C)c1ccc(OC2CCN(S(C)(=O)=O)CC2)cc1.CC(C)(C)c1ccc(OC2CCNCC2)cc1.CC(C)(C)c1cccc(CC2CCN(CC(F)(F)F)C2)c1.CC(C)N1CCC(Cc2cccc(C(C)(C)C)c2)C1.CC(C)N1CCC(Cc2cccc(C(C)(C)C)c2)CC1.CC(C)N1CCC(Oc2ccc(C(C)(C)C)cc2)CC1.CN1CCC(Oc2ccc(C(C)(C)C)cc2)CC1
InChIInChI=1S/C19H31N.C18H29NO.C18H29N.C17H24F3N.C17H26N2O.C17H25NO2.C16H25NO3S.C16H25NO.C15H23NO/c1-15(2)20-11-9-16(10-12-20)13-17-7-6-8-18(14-17)19(3,4)5;1-14(2)19-12-10-17(11-13-19)20-16-8-6-15(7-9-16)18(3,4)5;1-14(2)19-10-9-16(13-19)11-15-7-6-8-17(12-15)18(3,4)5;1-16(2,3)15-6-4-5-13(10-15)9-14-7-8-21(11-14)12-17(18,19)20;1-14(20)19-10-8-18(9-11-19)13-15-6-5-7-16(12-15)17(2,3)4;1-13(19)18-11-9-16(10-12-18)20-15-7-5-14(6-8-15)17(2,3)4;1-16(2,3)13-5-7-14(8-6-13)20-15-9-11-17(12-10-15)21(4,18)19;1-16(2,3)13-5-7-14(8-6-13)18-15-9-11-17(4)12-10-15;1-15(2,3)12-4-6-13(7-5-12)17-14-8-10-16-11-9-14/h6-8,14-16H,9-13H2,1-5H3;6-9,14,17H,10-13H2,1-5H3;6-8,12,14,16H,9-11,13H2,1-5H3;4-6,10,14H,7-9,11-12H2,1-3H3;5-7,12H,8-11,13H2,1-4H3;5-8,16H,9-12H2,1-4H3;5-8,15H,9-12H2,1-4H3;5-8,15H,9-12H2,1-4H3;4-7,14,16H,8-11H2,1-3H3
InChIKeyJSGXIQGKFJNBFT-UHFFFAOYSA-N
XLogP32.93
TPSA155.62 Ų
H-Bond Donors1
H-Bond Acceptors16
Rotatable Bonds23
Heavy Atoms176
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002449.70
LogP ≤ 532.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1016

Analyze 4-(4-tert-butylphenoxy)-1-methylpiperidine;4-(4-tert-butylphenoxy)-1-methylsulfonylpiperidine;4-(4-tert-butylphenoxy)piperidine;1-[4-(4-tert-butylphenoxy)piperidin-1-yl]ethanone;4-(4-tert-butylphenoxy)-1-propan-2-ylpiperidine;1-[4-[(3-tert-butylphenyl)methyl]piperazin-1-yl]ethanone;4-[(3-tert-butylphenyl)methyl]-1-propan-2-ylpiperidine;3-[(3-tert-butylphenyl)methyl]-1-propan-2-ylpyrrolidine;3-[(3-tert-butylphenyl)methyl]-1-(2,2,2-trifluoroethyl)pyrrolidine with MolForge

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Related Compounds

3-[(3-Tert-butyl-4-methylphenyl)methyl]oxetane;3-[(3-tert-butyl-4-methylphenyl)methyl]oxolane;4-(4-tert-butylphenoxy)piperidine;4-[(3-tert-butylphenyl)methyl]oxan-3-ol;1-[4-[(3-tert-butylphenyl)methyl]piperazin-1-yl]ethanone;4-[(3-tert-butylphenyl)methyl]-1-propan-2-ylpiperidine;3-[(3-tert-butylphenyl)methyl]-1-propan-2-ylpyrrolidine;3-[(3-tert-butylphenyl)methyl]-1-(2,2,2-trifluoroethyl)pyrrolidine;4-(3-tert-butylphenyl)oxane
CID 157252748
1-tert-butyl-4-(3-methoxypropoxy)benzene;3-(3-tert-butylphenoxy)-1-propan-2-ylpyrrolidine;1-[3-(3-tert-butylphenoxy)pyrrolidin-1-yl]ethanone;3-(3-tert-butylphenoxy)-1-(2,2,2-trifluoroethyl)pyrrolidine;4-[(4-tert-butylphenyl)methyl]morpholine;N-(4-tert-butylphenyl)-N-methyloxolan-3-amine;1-[(4-tert-butylphenyl)methyl]piperazine;2-[4-[(3-tert-butylphenyl)methyl]piperazin-1-yl]ethanamine;N-(4-tert-butylphenyl)-1-methylpiperidin-4-amine;N-(4-tert-butylphenyl)-1-methylsulfonylpiperidin-4-amine;N-(4-tert-butylphenyl)piperidin-4-amine;N-(4-tert-butylphenyl)-1-propan-2-ylpiperidin-4-amine
CID 157627718
3-[(3-Tert-butyl-4-methylphenyl)methyl]oxetane;3-[(3-tert-butyl-4-methylphenyl)methyl]oxolane;4-(4-tert-butylphenoxy)-1-methylpiperidine;4-(4-tert-butylphenoxy)piperidine;4-[(3-tert-butylphenyl)methyl]oxan-3-ol;1-[4-[(3-tert-butylphenyl)methyl]piperazin-1-yl]ethanone;4-[(3-tert-butylphenyl)methyl]-1-propan-2-ylpiperidine;3-[(3-tert-butylphenyl)methyl]-1-propan-2-ylpyrrolidine;3-[(3-tert-butylphenyl)methyl]-1-(2,2,2-trifluoroethyl)pyrrolidine;4-(3-tert-butylphenyl)oxane
CID 157790454
3-(3-tert-butylphenoxy)pyrrolidine;4-(4-tert-butylphenoxy)-1-(2,2,2-trifluoroethyl)piperidine;4-(3-tert-butylphenyl)-N,N-dimethylbutanamide;1-[(3-tert-butylphenyl)methyl]-4-(2-methoxyethyl)piperazine;[1-[(3-tert-butylphenyl)methyl]-4-methylpiperazin-2-yl]methanol;3-[(3-tert-butylphenyl)methyl]-1-methylpyrrolidine;4-[(3-tert-butylphenyl)methyl]oxane;2-[4-[(3-tert-butylphenyl)methyl]piperazin-1-yl]ethanol;1-[3-[(3-tert-butylphenyl)methyl]pyrrolidin-1-yl]ethanone
CID 158696480
3-[(3-Tert-butyl-4-methylphenyl)methyl]oxetane;4-(4-tert-butylphenoxy)-1-methylpiperidine;4-(4-tert-butylphenoxy)piperidine;4-(4-tert-butylphenoxy)-1-propan-2-ylpiperidine;4-[(3-tert-butylphenyl)methyl]oxan-3-ol;1-[4-[(3-tert-butylphenyl)methyl]piperazin-1-yl]ethanone;4-[(3-tert-butylphenyl)methyl]-1-propan-2-ylpiperidine;3-[(3-tert-butylphenyl)methyl]-1-propan-2-ylpyrrolidine;3-[(3-tert-butylphenyl)methyl]-1-(2,2,2-trifluoroethyl)pyrrolidine;4-(3-tert-butylphenyl)oxane
CID 159023316
3-[(3-Tert-butyl-4-methylphenyl)methyl]oxetane;4-(4-tert-butylphenoxy)-1-methylpiperidine;4-(4-tert-butylphenoxy)piperidine;4-[(3-tert-butylphenyl)methyl]oxan-3-ol;3-[(3-tert-butylphenyl)methyl]oxolane;1-[4-[(3-tert-butylphenyl)methyl]piperazin-1-yl]ethanone;4-[(3-tert-butylphenyl)methyl]-1-propan-2-ylpiperidine;3-[(3-tert-butylphenyl)methyl]-1-propan-2-ylpyrrolidine;3-[(3-tert-butylphenyl)methyl]-1-(2,2,2-trifluoroethyl)pyrrolidine;4-(3-tert-butylphenyl)oxane
CID 159205539
4-(4-Tert-butylphenoxy)piperidine;1-[(3-tert-butylphenyl)methyl]-4-methylsulfonylpiperazine;4-[(3-tert-butylphenyl)methyl]oxan-3-ol;3-[(3-tert-butylphenyl)methyl]oxetane;3-[(3-tert-butylphenyl)methyl]oxolane;1-[4-[(3-tert-butylphenyl)methyl]piperazin-1-yl]ethanone;4-[(3-tert-butylphenyl)methyl]piperidine;4-[(3-tert-butylphenyl)methyl]-1-propan-2-ylpiperidine;3-[(3-tert-butylphenyl)methyl]-1-propan-2-ylpyrrolidine;1-[(3-tert-butylphenyl)methyl]-4-(2,2,2-trifluoroethyl)piperazine;3-[(3-tert-butylphenyl)methyl]-1-(2,2,2-trifluoroethyl)pyrrolidine;4-(3-tert-butylphenyl)oxane
CID 159512362
3-[(3-Tert-butyl-4-methylphenyl)methyl]oxetane;4-(3-tert-butyl-4-methylphenyl)oxane;4-(4-tert-butylphenoxy)-1-methylpiperidine;4-(4-tert-butylphenoxy)piperidine;4-(4-tert-butylphenoxy)-1-propan-2-ylpiperidine;4-[(3-tert-butylphenyl)methyl]oxan-3-ol;1-[4-[(3-tert-butylphenyl)methyl]piperazin-1-yl]ethanone;4-[(3-tert-butylphenyl)methyl]-1-propan-2-ylpiperidine;3-[(3-tert-butylphenyl)methyl]-1-propan-2-ylpyrrolidine;3-[(3-tert-butylphenyl)methyl]-1-(2,2,2-trifluoroethyl)pyrrolidine
CID 159695238
3-[(3-Tert-butyl-4-methylphenyl)methyl]oxetane;4-(4-tert-butylphenoxy)-1-methylpiperidine;4-(4-tert-butylphenoxy)piperidine;1-[4-(4-tert-butylphenoxy)piperidin-1-yl]ethanone;4-(4-tert-butylphenoxy)-1-propan-2-ylpiperidine;4-[(3-tert-butylphenyl)methyl]oxan-3-ol;1-[4-[(3-tert-butylphenyl)methyl]piperazin-1-yl]ethanone;4-[(3-tert-butylphenyl)methyl]-1-propan-2-ylpiperidine;3-[(3-tert-butylphenyl)methyl]-1-propan-2-ylpyrrolidine;3-[(3-tert-butylphenyl)methyl]-1-(2,2,2-trifluoroethyl)pyrrolidine;4-(3-tert-butylphenyl)oxane
CID 160034969
3-[(3-Tert-butyl-4-methylphenyl)methyl]oxetane;3-[(3-tert-butyl-4-methylphenyl)methyl]oxolane;4-(4-tert-butylphenoxy)piperidine;4-[(3-tert-butylphenyl)methyl]oxan-3-ol;1-[4-[(3-tert-butylphenyl)methyl]piperazin-1-yl]ethanone;4-[(3-tert-butylphenyl)methyl]piperidine;4-[(3-tert-butylphenyl)methyl]-1-propan-2-ylpiperidine;3-[(3-tert-butylphenyl)methyl]-1-propan-2-ylpyrrolidine;3-[(3-tert-butylphenyl)methyl]-1-(2,2,2-trifluoroethyl)pyrrolidine;4-(3-tert-butylphenyl)oxane
CID 160865254
4-(4-Tert-butylphenoxy)-1-methylpiperidine;4-(4-tert-butylphenoxy)piperidine;1-[4-(4-tert-butylphenoxy)piperidin-1-yl]ethanone;4-(4-tert-butylphenoxy)-1-propan-2-ylpiperidine;4-[(3-tert-butylphenyl)methyl]oxan-3-ol;1-[4-[(3-tert-butylphenyl)methyl]piperazin-1-yl]ethanone;4-[(3-tert-butylphenyl)methyl]-1-propan-2-ylpiperidine;3-[(3-tert-butylphenyl)methyl]-1-propan-2-ylpyrrolidine;3-[(3-tert-butylphenyl)methyl]-1-(2,2,2-trifluoroethyl)pyrrolidine;4-(3-tert-butylphenyl)oxane
CID 161304553
3-[(3-Tert-butyl-4-methylphenyl)methyl]oxetane;4-(4-tert-butylphenoxy)piperidine;1-[(3-tert-butylphenyl)methyl]-4-methylsulfonylpiperazine;4-[(3-tert-butylphenyl)methyl]oxan-3-ol;3-[(3-tert-butylphenyl)methyl]oxolane;1-[4-[(3-tert-butylphenyl)methyl]piperazin-1-yl]ethanone;4-[(3-tert-butylphenyl)methyl]piperidine;4-[(3-tert-butylphenyl)methyl]-1-propan-2-ylpiperidine;3-[(3-tert-butylphenyl)methyl]-1-propan-2-ylpyrrolidine;1-[(3-tert-butylphenyl)methyl]-4-(2,2,2-trifluoroethyl)piperazine;3-[(3-tert-butylphenyl)methyl]-1-(2,2,2-trifluoroethyl)pyrrolidine;4-(3-tert-butylphenyl)oxane
CID 161560033

Frequently Asked Questions

What is the IUPAC name of 4-(4-tert-butylphenoxy)-1-methylpiperidine;4-(4-tert-butylphenoxy)-1-methylsulfonylpiperidine;4-(4-tert-butylphenoxy)piperidine;1-[4-(4-tert-butylphenoxy)piperidin-1-yl]ethanone;4-(4-tert-butylphenoxy)-1-propan-2-ylpiperidine;1-[4-[(3-tert-butylphenyl)methyl]piperazin-1-yl]ethanone;4-[(3-tert-butylphenyl)methyl]-1-propan-2-ylpiperidine;3-[(3-tert-butylphenyl)methyl]-1-propan-2-ylpyrrolidine;3-[(3-tert-butylphenyl)methyl]-1-(2,2,2-trifluoroethyl)pyrrolidine?
The IUPAC name of 4-(4-tert-butylphenoxy)-1-methylpiperidine;4-(4-tert-butylphenoxy)-1-methylsulfonylpiperidine;4-(4-tert-butylphenoxy)piperidine;1-[4-(4-tert-butylphenoxy)piperidin-1-yl]ethanone;4-(4-tert-butylphenoxy)-1-propan-2-ylpiperidine;1-[4-[(3-tert-butylphenyl)methyl]piperazin-1-yl]ethanone;4-[(3-tert-butylphenyl)methyl]-1-propan-2-ylpiperidine;3-[(3-tert-butylphenyl)methyl]-1-propan-2-ylpyrrolidine;3-[(3-tert-butylphenyl)methyl]-1-(2,2,2-trifluoroethyl)pyrrolidine (CID 159009023) is 4-(4-tert-butylphenoxy)-1-methylpiperidine;4-(4-tert-butylphenoxy)-1-methylsulfonylpiperidine;4-(4-tert-butylphenoxy)piperidine;1-[4-(4-tert-butylphenoxy)piperidin-1-yl]ethanone;4-(4-tert-butylphenoxy)-1-propan-2-ylpiperidine;1-[4-[(3-tert-butylphenyl)methyl]piperazin-1-yl]ethanone;4-[(3-tert-butylphenyl)methyl]-1-propan-2-ylpiperidine;3-[(3-tert-butylphenyl)methyl]-1-propan-2-ylpyrrolidine;3-[(3-tert-butylphenyl)methyl]-1-(2,2,2-trifluoroethyl)pyrrolidine.
What is the SMILES notation for 4-(4-tert-butylphenoxy)-1-methylpiperidine;4-(4-tert-butylphenoxy)-1-methylsulfonylpiperidine;4-(4-tert-butylphenoxy)piperidine;1-[4-(4-tert-butylphenoxy)piperidin-1-yl]ethanone;4-(4-tert-butylphenoxy)-1-propan-2-ylpiperidine;1-[4-[(3-tert-butylphenyl)methyl]piperazin-1-yl]ethanone;4-[(3-tert-butylphenyl)methyl]-1-propan-2-ylpiperidine;3-[(3-tert-butylphenyl)methyl]-1-propan-2-ylpyrrolidine;3-[(3-tert-butylphenyl)methyl]-1-(2,2,2-trifluoroethyl)pyrrolidine?
The canonical SMILES for 4-(4-tert-butylphenoxy)-1-methylpiperidine;4-(4-tert-butylphenoxy)-1-methylsulfonylpiperidine;4-(4-tert-butylphenoxy)piperidine;1-[4-(4-tert-butylphenoxy)piperidin-1-yl]ethanone;4-(4-tert-butylphenoxy)-1-propan-2-ylpiperidine;1-[4-[(3-tert-butylphenyl)methyl]piperazin-1-yl]ethanone;4-[(3-tert-butylphenyl)methyl]-1-propan-2-ylpiperidine;3-[(3-tert-butylphenyl)methyl]-1-propan-2-ylpyrrolidine;3-[(3-tert-butylphenyl)methyl]-1-(2,2,2-trifluoroethyl)pyrrolidine is CC(=O)N1CCC(Oc2ccc(C(C)(C)C)cc2)CC1.CC(=O)N1CCN(Cc2cccc(C(C)(C)C)c2)CC1.CC(C)(C)c1ccc(OC2CCN(S(C)(=O)=O)CC2)cc1.CC(C)(C)c1ccc(OC2CCNCC2)cc1.CC(C)(C)c1cccc(CC2CCN(CC(F)(F)F)C2)c1.CC(C)N1CCC(Cc2cccc(C(C)(C)C)c2)C1.CC(C)N1CCC(Cc2cccc(C(C)(C)C)c2)CC1.CC(C)N1CCC(Oc2ccc(C(C)(C)C)cc2)CC1.CN1CCC(Oc2ccc(C(C)(C)C)cc2)CC1.
What is the InChIKey of 4-(4-tert-butylphenoxy)-1-methylpiperidine;4-(4-tert-butylphenoxy)-1-methylsulfonylpiperidine;4-(4-tert-butylphenoxy)piperidine;1-[4-(4-tert-butylphenoxy)piperidin-1-yl]ethanone;4-(4-tert-butylphenoxy)-1-propan-2-ylpiperidine;1-[4-[(3-tert-butylphenyl)methyl]piperazin-1-yl]ethanone;4-[(3-tert-butylphenyl)methyl]-1-propan-2-ylpiperidine;3-[(3-tert-butylphenyl)methyl]-1-propan-2-ylpyrrolidine;3-[(3-tert-butylphenyl)methyl]-1-(2,2,2-trifluoroethyl)pyrrolidine?
The InChIKey is JSGXIQGKFJNBFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H31N.C18H29NO.C18H29N.C17H24F3N.C17H26N2O.C17H25NO2.C16H25NO3S.C16H25NO.C15H23NO/c1-15(2)20-11-9-16(10-12-20)13-17-7-6-8-18(14-17)19(3,4)5;1-14(2)19-12-10-17(11-13-19)20-16-8-6-15(7-9-16)18(3,4)5;1-14(2)19-10-9-16(13-19)11-15-7-6-8-17(12-15)18(3,4)5;1-16(2,3)15-6-4-5-13(10-15)9-14-7-8-21(11-14)12-17(18,19)20;1-14(20)19-10-8-18(9-11-19)13-15-6-5-7-16(12-15)17(2,3)4;1-13(19)18-11-9-16(10-12-18)20-15-7-5-14(6-8-15)17(2,3)4;1-16(2,3)13-5-7-14(8-6-13)20-15-9-11-17(12-10-15)21(4,18)19;1-16(2,3)13-5-7-14(8-6-13)18-15-9-11-17(4)12-10-15;1-15(2,3)12-4-6-13(7-5-12)17-14-8-10-16-11-9-14/h6-8,14-16H,9-13H2,1-5H3;6-9,14,17H,10-13H2,1-5H3;6-8,12,14,16H,9-11,13H2,1-5H3;4-6,10,14H,7-9,11-12H2,1-3H3;5-7,12H,8-11,13H2,1-4H3;5-8,16H,9-12H2,1-4H3;5-8,15H,9-12H2,1-4H3;5-8,15H,9-12H2,1-4H3;4-7,14,16H,8-11H2,1-3H3.
What are the key properties of 4-(4-tert-butylphenoxy)-1-methylpiperidine;4-(4-tert-butylphenoxy)-1-methylsulfonylpiperidine;4-(4-tert-butylphenoxy)piperidine;1-[4-(4-tert-butylphenoxy)piperidin-1-yl]ethanone;4-(4-tert-butylphenoxy)-1-propan-2-ylpiperidine;1-[4-[(3-tert-butylphenyl)methyl]piperazin-1-yl]ethanone;4-[(3-tert-butylphenyl)methyl]-1-propan-2-ylpiperidine;3-[(3-tert-butylphenyl)methyl]-1-propan-2-ylpyrrolidine;3-[(3-tert-butylphenyl)methyl]-1-(2,2,2-trifluoroethyl)pyrrolidine?
4-(4-tert-butylphenoxy)-1-methylpiperidine;4-(4-tert-butylphenoxy)-1-methylsulfonylpiperidine;4-(4-tert-butylphenoxy)piperidine;1-[4-(4-tert-butylphenoxy)piperidin-1-yl]ethanone;4-(4-tert-butylphenoxy)-1-propan-2-ylpiperidine;1-[4-[(3-tert-butylphenyl)methyl]piperazin-1-yl]ethanone;4-[(3-tert-butylphenyl)methyl]-1-propan-2-ylpiperidine;3-[(3-tert-butylphenyl)methyl]-1-propan-2-ylpyrrolidine;3-[(3-tert-butylphenyl)methyl]-1-(2,2,2-trifluoroethyl)pyrrolidine has a molecular weight of 2449.70 g/mol, XLogP of 32.93, 23 rotatable bonds, 1 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-tert-butylphenoxy)-1-methylpiperidine;4-(4-tert-butylphenoxy)-1-methylsulfonylpiperidine;4-(4-tert-butylphenoxy)piperidine;1-[4-(4-tert-butylphenoxy)piperidin-1-yl]ethanone;4-(4-tert-butylphenoxy)-1-propan-2-ylpiperidine;1-[4-[(3-tert-butylphenyl)methyl]piperazin-1-yl]ethanone;4-[(3-tert-butylphenyl)methyl]-1-propan-2-ylpiperidine;3-[(3-tert-butylphenyl)methyl]-1-propan-2-ylpyrrolidine;3-[(3-tert-butylphenyl)methyl]-1-(2,2,2-trifluoroethyl)pyrrolidine is sourced from PubChem (CID 159009023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).