1-cyclopropylsulfonyl-4-propan-2-ylbenzene;1-(2,2-dimethylpropoxy)-2-methyl-4-propan-2-ylbenzene;1-(2,2-dimethylpropoxy)-4-propan-2-ylbenzene;(2-ethoxy-4-propan-2-ylphenyl)methanol;1-ethylsulfonyl-2-methyl-4-propan-2-ylbenzene;1-fluoro-3-methoxy-5-propan-2-yl-2-propan-2-yloxybenzene;2-(2-fluoro-4-propan-2-ylphenyl)propan-2-ol;1-(3-methylbutan-2-yl)-4-propan-2-ylbenzene;3-(2-methyl-4-propan-2-ylphenoxy)propan-1-ol;2-methyl-1-propan-2-yl-4-propan-2-ylsulfonylbenzene;2-methyl-4-propan-2-yl-1-propan-2-ylsulfonylbenzene;2-methyl-4-propan-2-yl-1-propoxybenzene;1-(2-methylpropylsulfonyl)-4-propan-2-ylbenzene;1-(4-propan-2-ylphenyl)sulfonylpyrrolidine

C182H275F2NO22S6 — CID 161192265

IUPAC1-cyclopropylsulfonyl-4-propan-2-ylbenzene;1-(2,2-dimethylpropoxy)-2-methyl-4-propan-2-ylbenzene;1-(2,2-dimethylpropoxy)-4-propan-2-ylbenzene;(2-ethoxy-4-propan-2-ylphenyl)methanol;1-ethylsulfonyl-2-methyl-4-propan-2-ylbenzene;1-fluoro-3-methoxy-5-propan-2-yl-2-propan-2-yloxybenzene;2-(2-fluoro-4-propan-2-ylphenyl)propan-2-ol;1-(3-methylbutan-2-yl)-4-propan-2-ylbenzene;3-(2-methyl-4-propan-2-ylphenoxy)propan-1-ol;2-methyl-1-propan-2-yl-4-propan-2-ylsulfonylbenzene;2-methyl-4-propan-2-yl-1-propan-2-ylsulfonylbenzene;2-methyl-4-propan-2-yl-1-propoxybenzene;1-(2-methylpropylsulfonyl)-4-propan-2-ylbenzene;1-(4-propan-2-ylphenyl)sulfonylpyrrolidine
SMILESCC(C)CS(=O)(=O)c1ccc(C(C)C)cc1.CC(C)c1ccc(C(C)(C)O)c(F)c1.CC(C)c1ccc(C(C)C(C)C)cc1.CC(C)c1ccc(OCC(C)(C)C)cc1.CC(C)c1ccc(S(=O)(=O)C2CC2)cc1.CC(C)c1ccc(S(=O)(=O)N2CCCC2)cc1.CCCOc1ccc(C(C)C)cc1C.CCOc1cc(C(C)C)ccc1CO.CCS(=O)(=O)c1ccc(C(C)C)cc1C.COc1cc(C(C)C)cc(F)c1OC(C)C.Cc1cc(C(C)C)ccc1OCC(C)(C)C.Cc1cc(C(C)C)ccc1OCCCO.Cc1cc(C(C)C)ccc1S(=O)(=O)C(C)C.Cc1cc(S(=O)(=O)C(C)C)ccc1C(C)C
InChIInChI=1S/C15H24O.C14H22O.C14H22.C13H19FO2.C13H19NO2S.3C13H20O2S.C13H20O2.C13H20O.C12H17FO.C12H16O2S.C12H18O2S.C12H18O2/c1-11(2)13-7-8-14(12(3)9-13)16-10-15(4,5)6;1-11(2)12-6-8-13(9-7-12)15-10-14(3,4)5;1-10(2)12(5)14-8-6-13(7-9-14)11(3)4;1-8(2)10-6-11(14)13(16-9(3)4)12(7-10)15-5;1-11(2)12-5-7-13(8-6-12)17(15,16)14-9-3-4-10-14;1-9(2)13-7-6-12(8-11(13)5)16(14,15)10(3)4;1-9(2)12-6-7-13(11(5)8-12)16(14,15)10(3)4;1-10(2)9-16(14,15)13-7-5-12(6-8-13)11(3)4;1-10(2)12-5-6-13(11(3)9-12)15-8-4-7-14;1-5-8-14-13-7-6-12(10(2)3)9-11(13)4;1-8(2)9-5-6-10(11(13)7-9)12(3,4)14;1-9(2)10-3-5-11(6-4-10)15(13,14)12-7-8-12;1-5-15(13,14)12-7-6-11(9(2)3)8-10(12)4;1-4-14-12-7-10(9(2)3)5-6-11(12)8-13/h7-9,11H,10H2,1-6H3;6-9,11H,10H2,1-5H3;6-12H,1-5H3;6-9H,1-5H3;5-8,11H,3-4,9-10H2,1-2H3;2*6-10H,1-5H3;5-8,10-11H,9H2,1-4H3;5-6,9-10,14H,4,7-8H2,1-3H3;6-7,9-10H,5,8H2,1-4H3;5-8,14H,1-4H3;3-6,9,12H,7-8H2,1-2H3;6-9H,5H2,1-4H3;5-7,9,13H,4,8H2,1-3H3
InChIKeyUTWMTKKYNBSICF-UHFFFAOYSA-N
MW3059.58 g/mol
LogP47.85
Rot. Bonds47

About 1-cyclopropylsulfonyl-4-propan-2-ylbenzene;1-(2,2-dimethylpropoxy)-2-methyl-4-propan-2-ylbenzene;1-(2,2-dimethylpropoxy)-4-propan-2-ylbenzene;(2-ethoxy-4-propan-2-ylphenyl)methanol;1-ethylsulfonyl-2-methyl-4-propan-2-ylbenzene;1-fluoro-3-methoxy-5-propan-2-yl-2-propan-2-yloxybenzene;2-(2-fluoro-4-propan-2-ylphenyl)propan-2-ol;1-(3-methylbutan-2-yl)-4-propan-2-ylbenzene;3-(2-methyl-4-propan-2-ylphenoxy)propan-1-ol;2-methyl-1-propan-2-yl-4-propan-2-ylsulfonylbenzene;2-methyl-4-propan-2-yl-1-propan-2-ylsulfonylbenzene;2-methyl-4-propan-2-yl-1-propoxybenzene;1-(2-methylpropylsulfonyl)-4-propan-2-ylbenzene;1-(4-propan-2-ylphenyl)sulfonylpyrrolidine

1-cyclopropylsulfonyl-4-propan-2-ylbenzene;1-(2,2-dimethylpropoxy)-2-methyl-4-propan-2-ylbenzene;1-(2,2-dimethylpropoxy)-4-propan-2-ylbenzene;(2-ethoxy-4-propan-2-ylphenyl)methanol;1-ethylsulfonyl-2-methyl-4-propan-2-ylbenzene;1-fluoro-3-methoxy-5-propan-2-yl-2-propan-2-yloxybenzene;2-(2-fluoro-4-propan-2-ylphenyl)propan-2-ol;1-(3-methylbutan-2-yl)-4-propan-2-ylbenzene;3-(2-methyl-4-propan-2-ylphenoxy)propan-1-ol;2-methyl-1-propan-2-yl-4-propan-2-ylsulfonylbenzene;2-methyl-4-propan-2-yl-1-propan-2-ylsulfonylbenzene;2-methyl-4-propan-2-yl-1-propoxybenzene;1-(2-methylpropylsulfonyl)-4-propan-2-ylbenzene;1-(4-propan-2-ylphenyl)sulfonylpyrrolidine (PubChem CID 161192265) has the molecular formula C182H275F2NO22S6 and a molecular weight of 3059.58 g/mol. Its IUPAC name is 1-cyclopropylsulfonyl-4-propan-2-ylbenzene;1-(2,2-dimethylpropoxy)-2-methyl-4-propan-2-ylbenzene;1-(2,2-dimethylpropoxy)-4-propan-2-ylbenzene;(2-ethoxy-4-propan-2-ylphenyl)methanol;1-ethylsulfonyl-2-methyl-4-propan-2-ylbenzene;1-fluoro-3-methoxy-5-propan-2-yl-2-propan-2-yloxybenzene;2-(2-fluoro-4-propan-2-ylphenyl)propan-2-ol;1-(3-methylbutan-2-yl)-4-propan-2-ylbenzene;3-(2-methyl-4-propan-2-ylphenoxy)propan-1-ol;2-methyl-1-propan-2-yl-4-propan-2-ylsulfonylbenzene;2-methyl-4-propan-2-yl-1-propan-2-ylsulfonylbenzene;2-methyl-4-propan-2-yl-1-propoxybenzene;1-(2-methylpropylsulfonyl)-4-propan-2-ylbenzene;1-(4-propan-2-ylphenyl)sulfonylpyrrolidine.

Molecular Properties

Compound Name1-cyclopropylsulfonyl-4-propan-2-ylbenzene;1-(2,2-dimethylpropoxy)-2-methyl-4-propan-2-ylbenzene;1-(2,2-dimethylpropoxy)-4-propan-2-ylbenzene;(2-ethoxy-4-propan-2-ylphenyl)methanol;1-ethylsulfonyl-2-methyl-4-propan-2-ylbenzene;1-fluoro-3-methoxy-5-propan-2-yl-2-propan-2-yloxybenzene;2-(2-fluoro-4-propan-2-ylphenyl)propan-2-ol;1-(3-methylbutan-2-yl)-4-propan-2-ylbenzene;3-(2-methyl-4-propan-2-ylphenoxy)propan-1-ol;2-methyl-1-propan-2-yl-4-propan-2-ylsulfonylbenzene;2-methyl-4-propan-2-yl-1-propan-2-ylsulfonylbenzene;2-methyl-4-propan-2-yl-1-propoxybenzene;1-(2-methylpropylsulfonyl)-4-propan-2-ylbenzene;1-(4-propan-2-ylphenyl)sulfonylpyrrolidine
PubChem CID161192265
Molecular FormulaC182H275F2NO22S6
Molecular Weight3059.58 g/mol
Exact Mass3056.87
IUPAC Name1-cyclopropylsulfonyl-4-propan-2-ylbenzene;1-(2,2-dimethylpropoxy)-2-methyl-4-propan-2-ylbenzene;1-(2,2-dimethylpropoxy)-4-propan-2-ylbenzene;(2-ethoxy-4-propan-2-ylphenyl)methanol;1-ethylsulfonyl-2-methyl-4-propan-2-ylbenzene;1-fluoro-3-methoxy-5-propan-2-yl-2-propan-2-yloxybenzene;2-(2-fluoro-4-propan-2-ylphenyl)propan-2-ol;1-(3-methylbutan-2-yl)-4-propan-2-ylbenzene;3-(2-methyl-4-propan-2-ylphenoxy)propan-1-ol;2-methyl-1-propan-2-yl-4-propan-2-ylsulfonylbenzene;2-methyl-4-propan-2-yl-1-propan-2-ylsulfonylbenzene;2-methyl-4-propan-2-yl-1-propoxybenzene;1-(2-methylpropylsulfonyl)-4-propan-2-ylbenzene;1-(4-propan-2-ylphenyl)sulfonylpyrrolidine
SMILESCC(C)CS(=O)(=O)c1ccc(C(C)C)cc1.CC(C)c1ccc(C(C)(C)O)c(F)c1.CC(C)c1ccc(C(C)C(C)C)cc1.CC(C)c1ccc(OCC(C)(C)C)cc1.CC(C)c1ccc(S(=O)(=O)C2CC2)cc1.CC(C)c1ccc(S(=O)(=O)N2CCCC2)cc1.CCCOc1ccc(C(C)C)cc1C.CCOc1cc(C(C)C)ccc1CO.CCS(=O)(=O)c1ccc(C(C)C)cc1C.COc1cc(C(C)C)cc(F)c1OC(C)C.Cc1cc(C(C)C)ccc1OCC(C)(C)C.Cc1cc(C(C)C)ccc1OCCCO.Cc1cc(C(C)C)ccc1S(=O)(=O)C(C)C.Cc1cc(S(=O)(=O)C(C)C)ccc1C(C)C
InChIInChI=1S/C15H24O.C14H22O.C14H22.C13H19FO2.C13H19NO2S.3C13H20O2S.C13H20O2.C13H20O.C12H17FO.C12H16O2S.C12H18O2S.C12H18O2/c1-11(2)13-7-8-14(12(3)9-13)16-10-15(4,5)6;1-11(2)12-6-8-13(9-7-12)15-10-14(3,4)5;1-10(2)12(5)14-8-6-13(7-9-14)11(3)4;1-8(2)10-6-11(14)13(16-9(3)4)12(7-10)15-5;1-11(2)12-5-7-13(8-6-12)17(15,16)14-9-3-4-10-14;1-9(2)13-7-6-12(8-11(13)5)16(14,15)10(3)4;1-9(2)12-6-7-13(11(5)8-12)16(14,15)10(3)4;1-10(2)9-16(14,15)13-7-5-12(6-8-13)11(3)4;1-10(2)12-5-6-13(11(3)9-12)15-8-4-7-14;1-5-8-14-13-7-6-12(10(2)3)9-11(13)4;1-8(2)9-5-6-10(11(13)7-9)12(3,4)14;1-9(2)10-3-5-11(6-4-10)15(13,14)12-7-8-12;1-5-15(13,14)12-7-6-11(9(2)3)8-10(12)4;1-4-14-12-7-10(9(2)3)5-6-11(12)8-13/h7-9,11H,10H2,1-6H3;6-9,11H,10H2,1-5H3;6-12H,1-5H3;6-9H,1-5H3;5-8,11H,3-4,9-10H2,1-2H3;2*6-10H,1-5H3;5-8,10-11H,9H2,1-4H3;5-6,9-10,14H,4,7-8H2,1-3H3;6-7,9-10H,5,8H2,1-4H3;5-8,14H,1-4H3;3-6,9,12H,7-8H2,1-2H3;6-9H,5H2,1-4H3;5-7,9,13H,4,8H2,1-3H3
InChIKeyUTWMTKKYNBSICF-UHFFFAOYSA-N
XLogP47.85
TPSA333.38 Ų
H-Bond Donors3
H-Bond Acceptors22
Rotatable Bonds47
Heavy Atoms213
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003059.58
LogP ≤ 547.85
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1022

Computed Properties (RDKit)

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

Analyze 1-cyclopropylsulfonyl-4-propan-2-ylbenzene;1-(2,2-dimethylpropoxy)-2-methyl-4-propan-2-ylbenzene;1-(2,2-dimethylpropoxy)-4-propan-2-ylbenzene;(2-ethoxy-4-propan-2-ylphenyl)methanol;1-ethylsulfonyl-2-methyl-4-propan-2-ylbenzene;1-fluoro-3-methoxy-5-propan-2-yl-2-propan-2-yloxybenzene;2-(2-fluoro-4-propan-2-ylphenyl)propan-2-ol;1-(3-methylbutan-2-yl)-4-propan-2-ylbenzene;3-(2-methyl-4-propan-2-ylphenoxy)propan-1-ol;2-methyl-1-propan-2-yl-4-propan-2-ylsulfonylbenzene;2-methyl-4-propan-2-yl-1-propan-2-ylsulfonylbenzene;2-methyl-4-propan-2-yl-1-propoxybenzene;1-(2-methylpropylsulfonyl)-4-propan-2-ylbenzene;1-(4-propan-2-ylphenyl)sulfonylpyrrolidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-butoxy-2-methoxy-4-propan-2-ylbenzene;1-tert-butyl-2-methoxy-4-propan-2-ylbenzene;1-tert-butylsulfonyl-4-propan-2-ylbenzene;1-cyclopropylsulfonyl-4-propan-2-ylbenzene;1-(difluoromethylsulfonyl)-4-propan-2-ylbenzene;2-(2-fluoro-4-propan-2-ylphenyl)propan-2-ol;1-methoxy-2-methyl-4-propan-2-ylbenzene;3-methoxy-4-propan-2-ylphenol;2-(2-methoxy-4-propan-2-ylphenoxy)ethanol;(3R)-3-(2-methoxy-4-propan-2-ylphenoxy)oxolane;2-(2-methoxy-4-propan-2-ylphenyl)-2-methylpropan-1-ol;2-(2-methoxy-4-propan-2-ylphenyl)propan-2-ol;2-methyl-4-propan-2-ylphenol;3-(4-propan-2-ylphenoxy)oxetane
CID 160609225
1-(4-ethoxy-3-methylphenyl)sulfonyl-3-(4-fluorophenyl)sulfonylpiperidine
CID 72718850
1-(4-ethoxy-3-methylphenyl)sulfonyl-N-[1-(4-methoxyphenyl)ethyl]piperidine-4-carboxamide
CID 43873109
1-(3-methyl-4-propoxyphenyl)sulfonyl-4-methylsulfonylpiperidine
CID 90585261
3-(4-chlorophenyl)sulfonyl-1-(4-ethoxy-3-methylphenyl)sulfonylpyrrolidine
CID 90587901
1-(4-butoxy-3-propan-2-ylphenyl)sulfonylpyrrolidine
CID 16645261
1-(4-heptoxy-3-methylphenyl)sulfonylpiperidine
CID 43845535
1-(4-ethoxy-3-methylphenyl)sulfonyl-3-(4-fluorophenyl)sulfonylazetidine
CID 90593218
1-(2-ethoxy-5-methylphenyl)sulfonyl-4-(4-methoxyphenyl)sulfonylpiperidine
CID 90592043
4-(4-methoxyphenyl)sulfonyl-1-[4-(2-methylpropoxy)phenyl]sulfonylpiperidine
CID 90592057
1-(4-butoxy-3-methylphenyl)sulfonyl-4-(2-ethoxyphenyl)piperazine
CID 100671557
1-(4-propoxyphenyl)sulfonylpyrrolidine
CID 60755176

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropylsulfonyl-4-propan-2-ylbenzene;1-(2,2-dimethylpropoxy)-2-methyl-4-propan-2-ylbenzene;1-(2,2-dimethylpropoxy)-4-propan-2-ylbenzene;(2-ethoxy-4-propan-2-ylphenyl)methanol;1-ethylsulfonyl-2-methyl-4-propan-2-ylbenzene;1-fluoro-3-methoxy-5-propan-2-yl-2-propan-2-yloxybenzene;2-(2-fluoro-4-propan-2-ylphenyl)propan-2-ol;1-(3-methylbutan-2-yl)-4-propan-2-ylbenzene;3-(2-methyl-4-propan-2-ylphenoxy)propan-1-ol;2-methyl-1-propan-2-yl-4-propan-2-ylsulfonylbenzene;2-methyl-4-propan-2-yl-1-propan-2-ylsulfonylbenzene;2-methyl-4-propan-2-yl-1-propoxybenzene;1-(2-methylpropylsulfonyl)-4-propan-2-ylbenzene;1-(4-propan-2-ylphenyl)sulfonylpyrrolidine?
The IUPAC name of 1-cyclopropylsulfonyl-4-propan-2-ylbenzene;1-(2,2-dimethylpropoxy)-2-methyl-4-propan-2-ylbenzene;1-(2,2-dimethylpropoxy)-4-propan-2-ylbenzene;(2-ethoxy-4-propan-2-ylphenyl)methanol;1-ethylsulfonyl-2-methyl-4-propan-2-ylbenzene;1-fluoro-3-methoxy-5-propan-2-yl-2-propan-2-yloxybenzene;2-(2-fluoro-4-propan-2-ylphenyl)propan-2-ol;1-(3-methylbutan-2-yl)-4-propan-2-ylbenzene;3-(2-methyl-4-propan-2-ylphenoxy)propan-1-ol;2-methyl-1-propan-2-yl-4-propan-2-ylsulfonylbenzene;2-methyl-4-propan-2-yl-1-propan-2-ylsulfonylbenzene;2-methyl-4-propan-2-yl-1-propoxybenzene;1-(2-methylpropylsulfonyl)-4-propan-2-ylbenzene;1-(4-propan-2-ylphenyl)sulfonylpyrrolidine (CID 161192265) is 1-cyclopropylsulfonyl-4-propan-2-ylbenzene;1-(2,2-dimethylpropoxy)-2-methyl-4-propan-2-ylbenzene;1-(2,2-dimethylpropoxy)-4-propan-2-ylbenzene;(2-ethoxy-4-propan-2-ylphenyl)methanol;1-ethylsulfonyl-2-methyl-4-propan-2-ylbenzene;1-fluoro-3-methoxy-5-propan-2-yl-2-propan-2-yloxybenzene;2-(2-fluoro-4-propan-2-ylphenyl)propan-2-ol;1-(3-methylbutan-2-yl)-4-propan-2-ylbenzene;3-(2-methyl-4-propan-2-ylphenoxy)propan-1-ol;2-methyl-1-propan-2-yl-4-propan-2-ylsulfonylbenzene;2-methyl-4-propan-2-yl-1-propan-2-ylsulfonylbenzene;2-methyl-4-propan-2-yl-1-propoxybenzene;1-(2-methylpropylsulfonyl)-4-propan-2-ylbenzene;1-(4-propan-2-ylphenyl)sulfonylpyrrolidine.
What is the SMILES notation for 1-cyclopropylsulfonyl-4-propan-2-ylbenzene;1-(2,2-dimethylpropoxy)-2-methyl-4-propan-2-ylbenzene;1-(2,2-dimethylpropoxy)-4-propan-2-ylbenzene;(2-ethoxy-4-propan-2-ylphenyl)methanol;1-ethylsulfonyl-2-methyl-4-propan-2-ylbenzene;1-fluoro-3-methoxy-5-propan-2-yl-2-propan-2-yloxybenzene;2-(2-fluoro-4-propan-2-ylphenyl)propan-2-ol;1-(3-methylbutan-2-yl)-4-propan-2-ylbenzene;3-(2-methyl-4-propan-2-ylphenoxy)propan-1-ol;2-methyl-1-propan-2-yl-4-propan-2-ylsulfonylbenzene;2-methyl-4-propan-2-yl-1-propan-2-ylsulfonylbenzene;2-methyl-4-propan-2-yl-1-propoxybenzene;1-(2-methylpropylsulfonyl)-4-propan-2-ylbenzene;1-(4-propan-2-ylphenyl)sulfonylpyrrolidine?
The canonical SMILES for 1-cyclopropylsulfonyl-4-propan-2-ylbenzene;1-(2,2-dimethylpropoxy)-2-methyl-4-propan-2-ylbenzene;1-(2,2-dimethylpropoxy)-4-propan-2-ylbenzene;(2-ethoxy-4-propan-2-ylphenyl)methanol;1-ethylsulfonyl-2-methyl-4-propan-2-ylbenzene;1-fluoro-3-methoxy-5-propan-2-yl-2-propan-2-yloxybenzene;2-(2-fluoro-4-propan-2-ylphenyl)propan-2-ol;1-(3-methylbutan-2-yl)-4-propan-2-ylbenzene;3-(2-methyl-4-propan-2-ylphenoxy)propan-1-ol;2-methyl-1-propan-2-yl-4-propan-2-ylsulfonylbenzene;2-methyl-4-propan-2-yl-1-propan-2-ylsulfonylbenzene;2-methyl-4-propan-2-yl-1-propoxybenzene;1-(2-methylpropylsulfonyl)-4-propan-2-ylbenzene;1-(4-propan-2-ylphenyl)sulfonylpyrrolidine is CC(C)CS(=O)(=O)c1ccc(C(C)C)cc1.CC(C)c1ccc(C(C)(C)O)c(F)c1.CC(C)c1ccc(C(C)C(C)C)cc1.CC(C)c1ccc(OCC(C)(C)C)cc1.CC(C)c1ccc(S(=O)(=O)C2CC2)cc1.CC(C)c1ccc(S(=O)(=O)N2CCCC2)cc1.CCCOc1ccc(C(C)C)cc1C.CCOc1cc(C(C)C)ccc1CO.CCS(=O)(=O)c1ccc(C(C)C)cc1C.COc1cc(C(C)C)cc(F)c1OC(C)C.Cc1cc(C(C)C)ccc1OCC(C)(C)C.Cc1cc(C(C)C)ccc1OCCCO.Cc1cc(C(C)C)ccc1S(=O)(=O)C(C)C.Cc1cc(S(=O)(=O)C(C)C)ccc1C(C)C.
What is the InChIKey of 1-cyclopropylsulfonyl-4-propan-2-ylbenzene;1-(2,2-dimethylpropoxy)-2-methyl-4-propan-2-ylbenzene;1-(2,2-dimethylpropoxy)-4-propan-2-ylbenzene;(2-ethoxy-4-propan-2-ylphenyl)methanol;1-ethylsulfonyl-2-methyl-4-propan-2-ylbenzene;1-fluoro-3-methoxy-5-propan-2-yl-2-propan-2-yloxybenzene;2-(2-fluoro-4-propan-2-ylphenyl)propan-2-ol;1-(3-methylbutan-2-yl)-4-propan-2-ylbenzene;3-(2-methyl-4-propan-2-ylphenoxy)propan-1-ol;2-methyl-1-propan-2-yl-4-propan-2-ylsulfonylbenzene;2-methyl-4-propan-2-yl-1-propan-2-ylsulfonylbenzene;2-methyl-4-propan-2-yl-1-propoxybenzene;1-(2-methylpropylsulfonyl)-4-propan-2-ylbenzene;1-(4-propan-2-ylphenyl)sulfonylpyrrolidine?
The InChIKey is UTWMTKKYNBSICF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24O.C14H22O.C14H22.C13H19FO2.C13H19NO2S.3C13H20O2S.C13H20O2.C13H20O.C12H17FO.C12H16O2S.C12H18O2S.C12H18O2/c1-11(2)13-7-8-14(12(3)9-13)16-10-15(4,5)6;1-11(2)12-6-8-13(9-7-12)15-10-14(3,4)5;1-10(2)12(5)14-8-6-13(7-9-14)11(3)4;1-8(2)10-6-11(14)13(16-9(3)4)12(7-10)15-5;1-11(2)12-5-7-13(8-6-12)17(15,16)14-9-3-4-10-14;1-9(2)13-7-6-12(8-11(13)5)16(14,15)10(3)4;1-9(2)12-6-7-13(11(5)8-12)16(14,15)10(3)4;1-10(2)9-16(14,15)13-7-5-12(6-8-13)11(3)4;1-10(2)12-5-6-13(11(3)9-12)15-8-4-7-14;1-5-8-14-13-7-6-12(10(2)3)9-11(13)4;1-8(2)9-5-6-10(11(13)7-9)12(3,4)14;1-9(2)10-3-5-11(6-4-10)15(13,14)12-7-8-12;1-5-15(13,14)12-7-6-11(9(2)3)8-10(12)4;1-4-14-12-7-10(9(2)3)5-6-11(12)8-13/h7-9,11H,10H2,1-6H3;6-9,11H,10H2,1-5H3;6-12H,1-5H3;6-9H,1-5H3;5-8,11H,3-4,9-10H2,1-2H3;2*6-10H,1-5H3;5-8,10-11H,9H2,1-4H3;5-6,9-10,14H,4,7-8H2,1-3H3;6-7,9-10H,5,8H2,1-4H3;5-8,14H,1-4H3;3-6,9,12H,7-8H2,1-2H3;6-9H,5H2,1-4H3;5-7,9,13H,4,8H2,1-3H3.
What are the key properties of 1-cyclopropylsulfonyl-4-propan-2-ylbenzene;1-(2,2-dimethylpropoxy)-2-methyl-4-propan-2-ylbenzene;1-(2,2-dimethylpropoxy)-4-propan-2-ylbenzene;(2-ethoxy-4-propan-2-ylphenyl)methanol;1-ethylsulfonyl-2-methyl-4-propan-2-ylbenzene;1-fluoro-3-methoxy-5-propan-2-yl-2-propan-2-yloxybenzene;2-(2-fluoro-4-propan-2-ylphenyl)propan-2-ol;1-(3-methylbutan-2-yl)-4-propan-2-ylbenzene;3-(2-methyl-4-propan-2-ylphenoxy)propan-1-ol;2-methyl-1-propan-2-yl-4-propan-2-ylsulfonylbenzene;2-methyl-4-propan-2-yl-1-propan-2-ylsulfonylbenzene;2-methyl-4-propan-2-yl-1-propoxybenzene;1-(2-methylpropylsulfonyl)-4-propan-2-ylbenzene;1-(4-propan-2-ylphenyl)sulfonylpyrrolidine?
1-cyclopropylsulfonyl-4-propan-2-ylbenzene;1-(2,2-dimethylpropoxy)-2-methyl-4-propan-2-ylbenzene;1-(2,2-dimethylpropoxy)-4-propan-2-ylbenzene;(2-ethoxy-4-propan-2-ylphenyl)methanol;1-ethylsulfonyl-2-methyl-4-propan-2-ylbenzene;1-fluoro-3-methoxy-5-propan-2-yl-2-propan-2-yloxybenzene;2-(2-fluoro-4-propan-2-ylphenyl)propan-2-ol;1-(3-methylbutan-2-yl)-4-propan-2-ylbenzene;3-(2-methyl-4-propan-2-ylphenoxy)propan-1-ol;2-methyl-1-propan-2-yl-4-propan-2-ylsulfonylbenzene;2-methyl-4-propan-2-yl-1-propan-2-ylsulfonylbenzene;2-methyl-4-propan-2-yl-1-propoxybenzene;1-(2-methylpropylsulfonyl)-4-propan-2-ylbenzene;1-(4-propan-2-ylphenyl)sulfonylpyrrolidine has a molecular weight of 3059.58 g/mol, XLogP of 47.85, 47 rotatable bonds, 3 hydrogen bond donors, and 22 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropylsulfonyl-4-propan-2-ylbenzene;1-(2,2-dimethylpropoxy)-2-methyl-4-propan-2-ylbenzene;1-(2,2-dimethylpropoxy)-4-propan-2-ylbenzene;(2-ethoxy-4-propan-2-ylphenyl)methanol;1-ethylsulfonyl-2-methyl-4-propan-2-ylbenzene;1-fluoro-3-methoxy-5-propan-2-yl-2-propan-2-yloxybenzene;2-(2-fluoro-4-propan-2-ylphenyl)propan-2-ol;1-(3-methylbutan-2-yl)-4-propan-2-ylbenzene;3-(2-methyl-4-propan-2-ylphenoxy)propan-1-ol;2-methyl-1-propan-2-yl-4-propan-2-ylsulfonylbenzene;2-methyl-4-propan-2-yl-1-propan-2-ylsulfonylbenzene;2-methyl-4-propan-2-yl-1-propoxybenzene;1-(2-methylpropylsulfonyl)-4-propan-2-ylbenzene;1-(4-propan-2-ylphenyl)sulfonylpyrrolidine is sourced from PubChem (CID 161192265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).