1-tert-butyl-4-cyclohexyloxybenzene;1-(4-tert-butylphenyl)imidazole;1-[(4-tert-butylphenyl)methyl]-4-methylpiperazine;1-[(3-tert-butylphenyl)methyl]piperidine;1-[(4-tert-butylphenyl)methyl]pyrrole;tris(1-(4-tert-butylphenyl)piperidine);1-(4-tert-butylphenyl)-4-propylpiperazine;1-(4-tert-butylphenyl)pyrazole;1-(3-tert-butylphenyl)sulfonylpiperidine;1-[4-tert-butyl-2-(trifluoromethyl)phenyl]piperidine

C182H268F3N15O3S — CID 161066537

IUPAC1-tert-butyl-4-cyclohexyloxybenzene;1-(4-tert-butylphenyl)imidazole;1-[(4-tert-butylphenyl)methyl]-4-methylpiperazine;1-[(3-tert-butylphenyl)methyl]piperidine;1-[(4-tert-butylphenyl)methyl]pyrrole;tris(1-(4-tert-butylphenyl)piperidine);1-(4-tert-butylphenyl)-4-propylpiperazine;1-(4-tert-butylphenyl)pyrazole;1-(3-tert-butylphenyl)sulfonylpiperidine;1-[4-tert-butyl-2-(trifluoromethyl)phenyl]piperidine
SMILESCC(C)(C)c1ccc(-n2cccn2)cc1.CC(C)(C)c1ccc(-n2ccnc2)cc1.CC(C)(C)c1ccc(Cn2cccc2)cc1.CC(C)(C)c1ccc(N2CCCCC2)c(C(F)(F)F)c1.CC(C)(C)c1ccc(N2CCCCC2)cc1.CC(C)(C)c1ccc(N2CCCCC2)cc1.CC(C)(C)c1ccc(N2CCCCC2)cc1.CC(C)(C)c1ccc(OC2CCCCC2)cc1.CC(C)(C)c1cccc(CN2CCCCC2)c1.CC(C)(C)c1cccc(S(=O)(=O)N2CCCCC2)c1.CCCN1CCN(c2ccc(C(C)(C)C)cc2)CC1.CN1CCN(Cc2ccc(C(C)(C)C)cc2)CC1
InChIInChI=1S/C17H28N2.C16H22F3N.C16H26N2.C16H25N.C16H24O.C15H23NO2S.C15H19N.3C15H23N.2C13H16N2/c1-5-10-18-11-13-19(14-12-18)16-8-6-15(7-9-16)17(2,3)4;1-15(2,3)12-7-8-14(13(11-12)16(17,18)19)20-9-5-4-6-10-20;1-16(2,3)15-7-5-14(6-8-15)13-18-11-9-17(4)10-12-18;1-16(2,3)15-9-7-8-14(12-15)13-17-10-5-4-6-11-17;1-16(2,3)13-9-11-15(12-10-13)17-14-7-5-4-6-8-14;1-15(2,3)13-8-7-9-14(12-13)19(17,18)16-10-5-4-6-11-16;1-15(2,3)14-8-6-13(7-9-14)12-16-10-4-5-11-16;3*1-15(2,3)13-7-9-14(10-8-13)16-11-5-4-6-12-16;1-13(2,3)11-5-7-12(8-6-11)15-10-4-9-14-15;1-13(2,3)11-4-6-12(7-5-11)15-9-8-14-10-15/h6-9H,5,10-14H2,1-4H3;7-8,11H,4-6,9-10H2,1-3H3;5-8H,9-13H2,1-4H3;7-9,12H,4-6,10-11,13H2,1-3H3;9-12,14H,4-8H2,1-3H3;7-9,12H,4-6,10-11H2,1-3H3;4-11H,12H2,1-3H3;3*7-10H,4-6,11-12H2,1-3H3;2*4-10H,1-3H3
InChIKeyUECCPWONZLFIQI-UHFFFAOYSA-N
MW2803.31 g/mol
LogP45.16
Rot. Bonds19

About 1-tert-butyl-4-cyclohexyloxybenzene;1-(4-tert-butylphenyl)imidazole;1-[(4-tert-butylphenyl)methyl]-4-methylpiperazine;1-[(3-tert-butylphenyl)methyl]piperidine;1-[(4-tert-butylphenyl)methyl]pyrrole;tris(1-(4-tert-butylphenyl)piperidine);1-(4-tert-butylphenyl)-4-propylpiperazine;1-(4-tert-butylphenyl)pyrazole;1-(3-tert-butylphenyl)sulfonylpiperidine;1-[4-tert-butyl-2-(trifluoromethyl)phenyl]piperidine

1-tert-butyl-4-cyclohexyloxybenzene;1-(4-tert-butylphenyl)imidazole;1-[(4-tert-butylphenyl)methyl]-4-methylpiperazine;1-[(3-tert-butylphenyl)methyl]piperidine;1-[(4-tert-butylphenyl)methyl]pyrrole;tris(1-(4-tert-butylphenyl)piperidine);1-(4-tert-butylphenyl)-4-propylpiperazine;1-(4-tert-butylphenyl)pyrazole;1-(3-tert-butylphenyl)sulfonylpiperidine;1-[4-tert-butyl-2-(trifluoromethyl)phenyl]piperidine (PubChem CID 161066537) has the molecular formula C182H268F3N15O3S and a molecular weight of 2803.31 g/mol. Its IUPAC name is 1-tert-butyl-4-cyclohexyloxybenzene;1-(4-tert-butylphenyl)imidazole;1-[(4-tert-butylphenyl)methyl]-4-methylpiperazine;1-[(3-tert-butylphenyl)methyl]piperidine;1-[(4-tert-butylphenyl)methyl]pyrrole;tris(1-(4-tert-butylphenyl)piperidine);1-(4-tert-butylphenyl)-4-propylpiperazine;1-(4-tert-butylphenyl)pyrazole;1-(3-tert-butylphenyl)sulfonylpiperidine;1-[4-tert-butyl-2-(trifluoromethyl)phenyl]piperidine.

Molecular Properties

Compound Name1-tert-butyl-4-cyclohexyloxybenzene;1-(4-tert-butylphenyl)imidazole;1-[(4-tert-butylphenyl)methyl]-4-methylpiperazine;1-[(3-tert-butylphenyl)methyl]piperidine;1-[(4-tert-butylphenyl)methyl]pyrrole;tris(1-(4-tert-butylphenyl)piperidine);1-(4-tert-butylphenyl)-4-propylpiperazine;1-(4-tert-butylphenyl)pyrazole;1-(3-tert-butylphenyl)sulfonylpiperidine;1-[4-tert-butyl-2-(trifluoromethyl)phenyl]piperidine
PubChem CID161066537
Molecular FormulaC182H268F3N15O3S
Molecular Weight2803.31 g/mol
Exact Mass2801.10
IUPAC Name1-tert-butyl-4-cyclohexyloxybenzene;1-(4-tert-butylphenyl)imidazole;1-[(4-tert-butylphenyl)methyl]-4-methylpiperazine;1-[(3-tert-butylphenyl)methyl]piperidine;1-[(4-tert-butylphenyl)methyl]pyrrole;tris(1-(4-tert-butylphenyl)piperidine);1-(4-tert-butylphenyl)-4-propylpiperazine;1-(4-tert-butylphenyl)pyrazole;1-(3-tert-butylphenyl)sulfonylpiperidine;1-[4-tert-butyl-2-(trifluoromethyl)phenyl]piperidine
SMILESCC(C)(C)c1ccc(-n2cccn2)cc1.CC(C)(C)c1ccc(-n2ccnc2)cc1.CC(C)(C)c1ccc(Cn2cccc2)cc1.CC(C)(C)c1ccc(N2CCCCC2)c(C(F)(F)F)c1.CC(C)(C)c1ccc(N2CCCCC2)cc1.CC(C)(C)c1ccc(N2CCCCC2)cc1.CC(C)(C)c1ccc(N2CCCCC2)cc1.CC(C)(C)c1ccc(OC2CCCCC2)cc1.CC(C)(C)c1cccc(CN2CCCCC2)c1.CC(C)(C)c1cccc(S(=O)(=O)N2CCCCC2)c1.CCCN1CCN(c2ccc(C(C)(C)C)cc2)CC1.CN1CCN(Cc2ccc(C(C)(C)C)cc2)CC1
InChIInChI=1S/C17H28N2.C16H22F3N.C16H26N2.C16H25N.C16H24O.C15H23NO2S.C15H19N.3C15H23N.2C13H16N2/c1-5-10-18-11-13-19(14-12-18)16-8-6-15(7-9-16)17(2,3)4;1-15(2,3)12-7-8-14(13(11-12)16(17,18)19)20-9-5-4-6-10-20;1-16(2,3)15-7-5-14(6-8-15)13-18-11-9-17(4)10-12-18;1-16(2,3)15-9-7-8-14(12-15)13-17-10-5-4-6-11-17;1-16(2,3)13-9-11-15(12-10-13)17-14-7-5-4-6-8-14;1-15(2,3)13-8-7-9-14(12-13)19(17,18)16-10-5-4-6-11-16;1-15(2,3)14-8-6-13(7-9-14)12-16-10-4-5-11-16;3*1-15(2,3)13-7-9-14(10-8-13)16-11-5-4-6-12-16;1-13(2,3)11-5-7-12(8-6-11)15-10-4-9-14-15;1-13(2,3)11-4-6-12(7-5-11)15-9-8-14-10-15/h6-9H,5,10-14H2,1-4H3;7-8,11H,4-6,9-10H2,1-3H3;5-8H,9-13H2,1-4H3;7-9,12H,4-6,10-11,13H2,1-3H3;9-12,14H,4-8H2,1-3H3;7-9,12H,4-6,10-11H2,1-3H3;4-11H,12H2,1-3H3;3*7-10H,4-6,11-12H2,1-3H3;2*4-10H,1-3H3
InChIKeyUECCPWONZLFIQI-UHFFFAOYSA-N
XLogP45.16
TPSA116.34 Ų
H-Bond Donors
H-Bond Acceptors17
Rotatable Bonds19
Heavy Atoms204
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002803.31
LogP ≤ 545.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1017

Analyze 1-tert-butyl-4-cyclohexyloxybenzene;1-(4-tert-butylphenyl)imidazole;1-[(4-tert-butylphenyl)methyl]-4-methylpiperazine;1-[(3-tert-butylphenyl)methyl]piperidine;1-[(4-tert-butylphenyl)methyl]pyrrole;tris(1-(4-tert-butylphenyl)piperidine);1-(4-tert-butylphenyl)-4-propylpiperazine;1-(4-tert-butylphenyl)pyrazole;1-(3-tert-butylphenyl)sulfonylpiperidine;1-[4-tert-butyl-2-(trifluoromethyl)phenyl]piperidine with MolForge

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Related Compounds

1-Tert-butyl-4-cyclohexyloxybenzene;1-[(4-tert-butylphenyl)methyl]-4-methylpiperazine;1-[(3-tert-butylphenyl)methyl]piperidine;1-[(4-tert-butylphenyl)methyl]pyrrole;tris(1-(4-tert-butylphenyl)piperidine);1-(4-tert-butylphenyl)-4-propylpiperazine;1-(4-tert-butylphenyl)pyrazole;5-tert-butyl-2-piperidin-1-ylpyridine;methane
CID 158225031
4-(4-Tert-butylphenoxy)piperidine;1-(4-tert-butylphenyl)imidazole;1-[(4-tert-butylphenyl)methyl]-4-methylpiperazine;4-[(3-tert-butylphenyl)methyl]morpholine;1-(4-tert-butylphenyl)-4-methylpiperazine;4-(4-tert-butylphenyl)morpholine;1-(4-tert-butylphenyl)piperazine;2-[4-(4-tert-butylphenyl)piperazin-1-yl]ethanol;1-(4-tert-butylphenyl)piperidine;1-(4-tert-butylphenyl)pyrazole;1-(5-tert-butyl-2-pyridinyl)piperazine
CID 159042031
1-Tert-butyl-4-cyclohexyloxybenzene;1-(4-tert-butylphenyl)imidazole;1-[(4-tert-butylphenyl)methyl]-4-methylpiperazine;1-[(3-tert-butylphenyl)methyl]piperidine;1-[(4-tert-butylphenyl)methyl]pyrrole;tris(1-(4-tert-butylphenyl)piperidine);1-(4-tert-butylphenyl)-4-propylpiperazine;1-(4-tert-butylphenyl)pyrazole
CID 159449493
1-tert-butyl-4-cyclohexylsulfonylbenzene;1-[2-(3-tert-butylphenoxy)ethyl]pyrrolidine;1-[2-(4-tert-butylphenoxy)ethyl]pyrrolidine;1-(4-tert-butylphenyl)imidazole;1-(4-tert-butylphenyl)-4-methylpiperazine;1-[(3-tert-butylphenyl)methyl]piperidine;1-[(4-tert-butylphenyl)methyl]piperidine;1-[(4-tert-butylphenyl)methyl]pyrazole;1-(3-tert-butylphenyl)piperidine;1-tert-butyl-4-propoxybenzene;4-tert-butyl-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide;methane
CID 160573314
4-(4-Tert-butylphenoxy)piperidine;1-[(4-tert-butylphenyl)methyl]imidazole;1-[(4-tert-butylphenyl)methyl]-4-methylpiperazine;4-[(3-tert-butylphenyl)methyl]morpholine;4-(4-tert-butylphenyl)morpholine;1-(4-tert-butylphenyl)piperazine;2-[4-(4-tert-butylphenyl)piperazin-1-yl]ethanol;1-(4-tert-butylphenyl)piperidine;1-(4-tert-butylphenyl)pyrazole;1-(3-tert-butylphenyl)sulfonylpiperidine;1-(5-tert-butyl-2-pyridinyl)piperazine
CID 160842984
4-(4-Tert-butylphenoxy)piperidine;1-[(4-tert-butylphenyl)methyl]imidazole;1-[(4-tert-butylphenyl)methyl]-4-methylpiperazine;4-[(3-tert-butylphenyl)methyl]morpholine;4-(4-tert-butylphenyl)morpholine;1-(4-tert-butylphenyl)piperazine;2-[4-(4-tert-butylphenyl)piperazin-1-yl]ethanol;1-(4-tert-butylphenyl)piperidine;1-(4-tert-butylphenyl)pyrazole;1-(5-tert-butyl-2-pyridinyl)piperazine
CID 161323258
1-Tert-butyl-4-cyclohexyloxybenzene;1-(4-tert-butylphenyl)imidazole;1-[(4-tert-butylphenyl)methyl]-4-methylpiperazine;tris(1-(4-tert-butylphenyl)piperidine);1-(4-tert-butylphenyl)-4-propylpiperazine;1-(4-tert-butylphenyl)pyrazole;5-tert-butyl-2-piperidin-1-ylpyridine
CID 161617943

Frequently Asked Questions

What is the IUPAC name of 1-tert-butyl-4-cyclohexyloxybenzene;1-(4-tert-butylphenyl)imidazole;1-[(4-tert-butylphenyl)methyl]-4-methylpiperazine;1-[(3-tert-butylphenyl)methyl]piperidine;1-[(4-tert-butylphenyl)methyl]pyrrole;tris(1-(4-tert-butylphenyl)piperidine);1-(4-tert-butylphenyl)-4-propylpiperazine;1-(4-tert-butylphenyl)pyrazole;1-(3-tert-butylphenyl)sulfonylpiperidine;1-[4-tert-butyl-2-(trifluoromethyl)phenyl]piperidine?
The IUPAC name of 1-tert-butyl-4-cyclohexyloxybenzene;1-(4-tert-butylphenyl)imidazole;1-[(4-tert-butylphenyl)methyl]-4-methylpiperazine;1-[(3-tert-butylphenyl)methyl]piperidine;1-[(4-tert-butylphenyl)methyl]pyrrole;tris(1-(4-tert-butylphenyl)piperidine);1-(4-tert-butylphenyl)-4-propylpiperazine;1-(4-tert-butylphenyl)pyrazole;1-(3-tert-butylphenyl)sulfonylpiperidine;1-[4-tert-butyl-2-(trifluoromethyl)phenyl]piperidine (CID 161066537) is 1-tert-butyl-4-cyclohexyloxybenzene;1-(4-tert-butylphenyl)imidazole;1-[(4-tert-butylphenyl)methyl]-4-methylpiperazine;1-[(3-tert-butylphenyl)methyl]piperidine;1-[(4-tert-butylphenyl)methyl]pyrrole;tris(1-(4-tert-butylphenyl)piperidine);1-(4-tert-butylphenyl)-4-propylpiperazine;1-(4-tert-butylphenyl)pyrazole;1-(3-tert-butylphenyl)sulfonylpiperidine;1-[4-tert-butyl-2-(trifluoromethyl)phenyl]piperidine.
What is the SMILES notation for 1-tert-butyl-4-cyclohexyloxybenzene;1-(4-tert-butylphenyl)imidazole;1-[(4-tert-butylphenyl)methyl]-4-methylpiperazine;1-[(3-tert-butylphenyl)methyl]piperidine;1-[(4-tert-butylphenyl)methyl]pyrrole;tris(1-(4-tert-butylphenyl)piperidine);1-(4-tert-butylphenyl)-4-propylpiperazine;1-(4-tert-butylphenyl)pyrazole;1-(3-tert-butylphenyl)sulfonylpiperidine;1-[4-tert-butyl-2-(trifluoromethyl)phenyl]piperidine?
The canonical SMILES for 1-tert-butyl-4-cyclohexyloxybenzene;1-(4-tert-butylphenyl)imidazole;1-[(4-tert-butylphenyl)methyl]-4-methylpiperazine;1-[(3-tert-butylphenyl)methyl]piperidine;1-[(4-tert-butylphenyl)methyl]pyrrole;tris(1-(4-tert-butylphenyl)piperidine);1-(4-tert-butylphenyl)-4-propylpiperazine;1-(4-tert-butylphenyl)pyrazole;1-(3-tert-butylphenyl)sulfonylpiperidine;1-[4-tert-butyl-2-(trifluoromethyl)phenyl]piperidine is CC(C)(C)c1ccc(-n2cccn2)cc1.CC(C)(C)c1ccc(-n2ccnc2)cc1.CC(C)(C)c1ccc(Cn2cccc2)cc1.CC(C)(C)c1ccc(N2CCCCC2)c(C(F)(F)F)c1.CC(C)(C)c1ccc(N2CCCCC2)cc1.CC(C)(C)c1ccc(N2CCCCC2)cc1.CC(C)(C)c1ccc(N2CCCCC2)cc1.CC(C)(C)c1ccc(OC2CCCCC2)cc1.CC(C)(C)c1cccc(CN2CCCCC2)c1.CC(C)(C)c1cccc(S(=O)(=O)N2CCCCC2)c1.CCCN1CCN(c2ccc(C(C)(C)C)cc2)CC1.CN1CCN(Cc2ccc(C(C)(C)C)cc2)CC1.
What is the InChIKey of 1-tert-butyl-4-cyclohexyloxybenzene;1-(4-tert-butylphenyl)imidazole;1-[(4-tert-butylphenyl)methyl]-4-methylpiperazine;1-[(3-tert-butylphenyl)methyl]piperidine;1-[(4-tert-butylphenyl)methyl]pyrrole;tris(1-(4-tert-butylphenyl)piperidine);1-(4-tert-butylphenyl)-4-propylpiperazine;1-(4-tert-butylphenyl)pyrazole;1-(3-tert-butylphenyl)sulfonylpiperidine;1-[4-tert-butyl-2-(trifluoromethyl)phenyl]piperidine?
The InChIKey is UECCPWONZLFIQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2.C16H22F3N.C16H26N2.C16H25N.C16H24O.C15H23NO2S.C15H19N.3C15H23N.2C13H16N2/c1-5-10-18-11-13-19(14-12-18)16-8-6-15(7-9-16)17(2,3)4;1-15(2,3)12-7-8-14(13(11-12)16(17,18)19)20-9-5-4-6-10-20;1-16(2,3)15-7-5-14(6-8-15)13-18-11-9-17(4)10-12-18;1-16(2,3)15-9-7-8-14(12-15)13-17-10-5-4-6-11-17;1-16(2,3)13-9-11-15(12-10-13)17-14-7-5-4-6-8-14;1-15(2,3)13-8-7-9-14(12-13)19(17,18)16-10-5-4-6-11-16;1-15(2,3)14-8-6-13(7-9-14)12-16-10-4-5-11-16;3*1-15(2,3)13-7-9-14(10-8-13)16-11-5-4-6-12-16;1-13(2,3)11-5-7-12(8-6-11)15-10-4-9-14-15;1-13(2,3)11-4-6-12(7-5-11)15-9-8-14-10-15/h6-9H,5,10-14H2,1-4H3;7-8,11H,4-6,9-10H2,1-3H3;5-8H,9-13H2,1-4H3;7-9,12H,4-6,10-11,13H2,1-3H3;9-12,14H,4-8H2,1-3H3;7-9,12H,4-6,10-11H2,1-3H3;4-11H,12H2,1-3H3;3*7-10H,4-6,11-12H2,1-3H3;2*4-10H,1-3H3.
What are the key properties of 1-tert-butyl-4-cyclohexyloxybenzene;1-(4-tert-butylphenyl)imidazole;1-[(4-tert-butylphenyl)methyl]-4-methylpiperazine;1-[(3-tert-butylphenyl)methyl]piperidine;1-[(4-tert-butylphenyl)methyl]pyrrole;tris(1-(4-tert-butylphenyl)piperidine);1-(4-tert-butylphenyl)-4-propylpiperazine;1-(4-tert-butylphenyl)pyrazole;1-(3-tert-butylphenyl)sulfonylpiperidine;1-[4-tert-butyl-2-(trifluoromethyl)phenyl]piperidine?
1-tert-butyl-4-cyclohexyloxybenzene;1-(4-tert-butylphenyl)imidazole;1-[(4-tert-butylphenyl)methyl]-4-methylpiperazine;1-[(3-tert-butylphenyl)methyl]piperidine;1-[(4-tert-butylphenyl)methyl]pyrrole;tris(1-(4-tert-butylphenyl)piperidine);1-(4-tert-butylphenyl)-4-propylpiperazine;1-(4-tert-butylphenyl)pyrazole;1-(3-tert-butylphenyl)sulfonylpiperidine;1-[4-tert-butyl-2-(trifluoromethyl)phenyl]piperidine has a molecular weight of 2803.31 g/mol, XLogP of 45.16, 19 rotatable bonds, 0 hydrogen bond donors, and 17 hydrogen bond acceptors.
Where does this data come from?
All data for 1-tert-butyl-4-cyclohexyloxybenzene;1-(4-tert-butylphenyl)imidazole;1-[(4-tert-butylphenyl)methyl]-4-methylpiperazine;1-[(3-tert-butylphenyl)methyl]piperidine;1-[(4-tert-butylphenyl)methyl]pyrrole;tris(1-(4-tert-butylphenyl)piperidine);1-(4-tert-butylphenyl)-4-propylpiperazine;1-(4-tert-butylphenyl)pyrazole;1-(3-tert-butylphenyl)sulfonylpiperidine;1-[4-tert-butyl-2-(trifluoromethyl)phenyl]piperidine is sourced from PubChem (CID 161066537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).