2-tert-butyl-N-(2-methylbutan-2-yl)-4-propan-2-ylbenzenesulfonamide;N-tert-butyl-2-(1-methylcyclopropyl)-4-propan-2-ylbenzenesulfonamide;N-tert-butyl-4-propan-2-yl-2-(trifluoromethyl)benzenesulfonamide;bis(N,2-ditert-butyl-N-ethyl-4-propan-2-ylbenzenesulfonamide);N,2-ditert-butyl-N-methyl-4-propan-2-ylbenzenesulfonamide;N-(2-methylbutan-2-yl)-4-propan-2-yl-2-(trifluoromethyl)benzenesulfonamide

C120H197F6N7O14S7 — CID 159571538

IUPAC2-tert-butyl-N-(2-methylbutan-2-yl)-4-propan-2-ylbenzenesulfonamide;N-tert-butyl-2-(1-methylcyclopropyl)-4-propan-2-ylbenzenesulfonamide;N-tert-butyl-4-propan-2-yl-2-(trifluoromethyl)benzenesulfonamide;bis(N,2-ditert-butyl-N-ethyl-4-propan-2-ylbenzenesulfonamide);N,2-ditert-butyl-N-methyl-4-propan-2-ylbenzenesulfonamide;N-(2-methylbutan-2-yl)-4-propan-2-yl-2-(trifluoromethyl)benzenesulfonamide
SMILESCC(C)c1ccc(S(=O)(=O)N(C)C(C)(C)C)c(C(C)(C)C)c1.CC(C)c1ccc(S(=O)(=O)NC(C)(C)C)c(C(F)(F)F)c1.CC(C)c1ccc(S(=O)(=O)NC(C)(C)C)c(C2(C)CC2)c1.CCC(C)(C)NS(=O)(=O)c1ccc(C(C)C)cc1C(C)(C)C.CCC(C)(C)NS(=O)(=O)c1ccc(C(C)C)cc1C(F)(F)F.CCN(C(C)(C)C)S(=O)(=O)c1ccc(C(C)C)cc1C(C)(C)C.CCN(C(C)(C)C)S(=O)(=O)c1ccc(C(C)C)cc1C(C)(C)C
InChIInChI=1S/2C19H33NO2S.2C18H31NO2S.C17H27NO2S.C15H22F3NO2S.C14H20F3NO2S/c2*1-10-20(19(7,8)9)23(21,22)17-12-11-15(14(2)3)13-16(17)18(4,5)6;1-13(2)14-10-11-16(15(12-14)17(3,4)5)22(20,21)19(9)18(6,7)8;1-9-18(7,8)19-22(20,21)16-11-10-14(13(2)3)12-15(16)17(4,5)6;1-12(2)13-7-8-15(14(11-13)17(6)9-10-17)21(19,20)18-16(3,4)5;1-6-14(4,5)19-22(20,21)13-8-7-11(10(2)3)9-12(13)15(16,17)18;1-9(2)10-6-7-12(11(8-10)14(15,16)17)21(19,20)18-13(3,4)5/h2*11-14H,10H2,1-9H3;10-13H,1-9H3;10-13,19H,9H2,1-8H3;7-8,11-12,18H,9-10H2,1-6H3;7-10,19H,6H2,1-5H3;6-9,18H,1-5H3
InChIKeyMHWNKPPCROMWLG-UHFFFAOYSA-N
MW2300.39 g/mol
LogP31.07
Rot. Bonds28

About 2-tert-butyl-N-(2-methylbutan-2-yl)-4-propan-2-ylbenzenesulfonamide;N-tert-butyl-2-(1-methylcyclopropyl)-4-propan-2-ylbenzenesulfonamide;N-tert-butyl-4-propan-2-yl-2-(trifluoromethyl)benzenesulfonamide;bis(N,2-ditert-butyl-N-ethyl-4-propan-2-ylbenzenesulfonamide);N,2-ditert-butyl-N-methyl-4-propan-2-ylbenzenesulfonamide;N-(2-methylbutan-2-yl)-4-propan-2-yl-2-(trifluoromethyl)benzenesulfonamide

2-tert-butyl-N-(2-methylbutan-2-yl)-4-propan-2-ylbenzenesulfonamide;N-tert-butyl-2-(1-methylcyclopropyl)-4-propan-2-ylbenzenesulfonamide;N-tert-butyl-4-propan-2-yl-2-(trifluoromethyl)benzenesulfonamide;bis(N,2-ditert-butyl-N-ethyl-4-propan-2-ylbenzenesulfonamide);N,2-ditert-butyl-N-methyl-4-propan-2-ylbenzenesulfonamide;N-(2-methylbutan-2-yl)-4-propan-2-yl-2-(trifluoromethyl)benzenesulfonamide (PubChem CID 159571538) has the molecular formula C120H197F6N7O14S7 and a molecular weight of 2300.39 g/mol. Its IUPAC name is 2-tert-butyl-N-(2-methylbutan-2-yl)-4-propan-2-ylbenzenesulfonamide;N-tert-butyl-2-(1-methylcyclopropyl)-4-propan-2-ylbenzenesulfonamide;N-tert-butyl-4-propan-2-yl-2-(trifluoromethyl)benzenesulfonamide;bis(N,2-ditert-butyl-N-ethyl-4-propan-2-ylbenzenesulfonamide);N,2-ditert-butyl-N-methyl-4-propan-2-ylbenzenesulfonamide;N-(2-methylbutan-2-yl)-4-propan-2-yl-2-(trifluoromethyl)benzenesulfonamide.

Molecular Properties

Compound Name2-tert-butyl-N-(2-methylbutan-2-yl)-4-propan-2-ylbenzenesulfonamide;N-tert-butyl-2-(1-methylcyclopropyl)-4-propan-2-ylbenzenesulfonamide;N-tert-butyl-4-propan-2-yl-2-(trifluoromethyl)benzenesulfonamide;bis(N,2-ditert-butyl-N-ethyl-4-propan-2-ylbenzenesulfonamide);N,2-ditert-butyl-N-methyl-4-propan-2-ylbenzenesulfonamide;N-(2-methylbutan-2-yl)-4-propan-2-yl-2-(trifluoromethyl)benzenesulfonamide
PubChem CID159571538
Molecular FormulaC120H197F6N7O14S7
Molecular Weight2300.39 g/mol
Exact Mass2298.29
IUPAC Name2-tert-butyl-N-(2-methylbutan-2-yl)-4-propan-2-ylbenzenesulfonamide;N-tert-butyl-2-(1-methylcyclopropyl)-4-propan-2-ylbenzenesulfonamide;N-tert-butyl-4-propan-2-yl-2-(trifluoromethyl)benzenesulfonamide;bis(N,2-ditert-butyl-N-ethyl-4-propan-2-ylbenzenesulfonamide);N,2-ditert-butyl-N-methyl-4-propan-2-ylbenzenesulfonamide;N-(2-methylbutan-2-yl)-4-propan-2-yl-2-(trifluoromethyl)benzenesulfonamide
SMILESCC(C)c1ccc(S(=O)(=O)N(C)C(C)(C)C)c(C(C)(C)C)c1.CC(C)c1ccc(S(=O)(=O)NC(C)(C)C)c(C(F)(F)F)c1.CC(C)c1ccc(S(=O)(=O)NC(C)(C)C)c(C2(C)CC2)c1.CCC(C)(C)NS(=O)(=O)c1ccc(C(C)C)cc1C(C)(C)C.CCC(C)(C)NS(=O)(=O)c1ccc(C(C)C)cc1C(F)(F)F.CCN(C(C)(C)C)S(=O)(=O)c1ccc(C(C)C)cc1C(C)(C)C.CCN(C(C)(C)C)S(=O)(=O)c1ccc(C(C)C)cc1C(C)(C)C
InChIInChI=1S/2C19H33NO2S.2C18H31NO2S.C17H27NO2S.C15H22F3NO2S.C14H20F3NO2S/c2*1-10-20(19(7,8)9)23(21,22)17-12-11-15(14(2)3)13-16(17)18(4,5)6;1-13(2)14-10-11-16(15(12-14)17(3,4)5)22(20,21)19(9)18(6,7)8;1-9-18(7,8)19-22(20,21)16-11-10-14(13(2)3)12-15(16)17(4,5)6;1-12(2)13-7-8-15(14(11-13)17(6)9-10-17)21(19,20)18-16(3,4)5;1-6-14(4,5)19-22(20,21)13-8-7-11(10(2)3)9-12(13)15(16,17)18;1-9(2)10-6-7-12(11(8-10)14(15,16)17)21(19,20)18-13(3,4)5/h2*11-14H,10H2,1-9H3;10-13H,1-9H3;10-13,19H,9H2,1-8H3;7-8,11-12,18H,9-10H2,1-6H3;7-10,19H,6H2,1-5H3;6-9,18H,1-5H3
InChIKeyMHWNKPPCROMWLG-UHFFFAOYSA-N
XLogP31.07
TPSA296.82 Ų
H-Bond Donors4
H-Bond Acceptors14
Rotatable Bonds28
Heavy Atoms154
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002300.39
LogP ≤ 531.07
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1014

Analyze 2-tert-butyl-N-(2-methylbutan-2-yl)-4-propan-2-ylbenzenesulfonamide;N-tert-butyl-2-(1-methylcyclopropyl)-4-propan-2-ylbenzenesulfonamide;N-tert-butyl-4-propan-2-yl-2-(trifluoromethyl)benzenesulfonamide;bis(N,2-ditert-butyl-N-ethyl-4-propan-2-ylbenzenesulfonamide);N,2-ditert-butyl-N-methyl-4-propan-2-ylbenzenesulfonamide;N-(2-methylbutan-2-yl)-4-propan-2-yl-2-(trifluoromethyl)benzenesulfonamide 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

2-tert-butyl-N-(2-methylbutan-2-yl)-4-propan-2-ylbenzenesulfonamide;2-tert-butyl-N-(1-methylcyclopropyl)-4-propan-2-ylbenzenesulfonamide;1-(2-tert-butyl-4-propan-2-ylphenyl)sulfonyl-2-methylpiperidine;2-tert-butyl-4-propan-2-yl-N-(2,2,2-trifluoroethyl)benzenesulfonamide;bis(N,2-ditert-butyl-N-ethyl-4-propan-2-ylbenzenesulfonamide);N,2-ditert-butyl-N-methyl-4-propan-2-ylbenzenesulfonamide
CID 162225156
N-tert-butyl-2-(difluoromethyl)-4-propan-2-ylbenzenesulfonamide;8-tert-butyl-4,4-dimethyl-2-methylidene-6-propan-2-yl-1,3-dihydroquinoline;N-tert-butyl-N-ethyl-4-propan-2-yl-2-(trifluoromethyl)benzenesulfonamide;N-tert-butyl-2-(2-hydroxypropan-2-yl)-4-propan-2-ylbenzenesulfonamide;1-(2-tert-butyl-4-propan-2-ylphenyl)piperidine;8-tert-butyl-1,4,4-trimethyl-6-propan-2-yl-3H-quinolin-2-one;2,2-dimethyl-1-[4-propan-2-yl-2-(trifluoromethyl)phenyl]sulfonylpiperidine;2,2-dimethyl-1-[4-propan-2-yl-2-(trifluoromethyl)phenyl]sulfonylpyrrolidine;N-(1-methoxy-2-methylpropan-2-yl)-4-propan-2-yl-2-(trifluoromethyl)benzenesulfonamide;N-(2-methylbutan-2-yl)-4-propan-2-yl-2-(trifluoromethyl)benzenesulfonamide
CID 159723901
5-[3-tert-butyl-4-[tert-butyl(methyl)sulfamoyl]phenyl]-1-(cyclohexylmethyl)-2-methylpyrrole-3-sulfonamide;5-[3-tert-butyl-4-(tert-butylsulfamoyl)phenyl]-1-(cyclohexylmethyl)-2-methylpyrrole-3-sulfonamide;5-[4-(tert-butylsulfamoyl)-3-(1-methylcyclopropyl)phenyl]-1-(cyclohexylmethyl)-2-methylpyrrole-3-sulfonamide
CID 158836226
2-tert-butyl-N-(2,2-dimethylpropyl)-N-methyl-4-propan-2-ylbenzenesulfonamide
CID 118185625
N-tert-butyl-3-chloro-2-(1-hydroxyethyl)-4-propan-2-ylbenzenesulfonamide;N-tert-butyl-2-(2-hydroxypropan-2-yl)-4-propan-2-ylbenzenesulfonamide;2-tert-butyl-N-(2-methylbutan-2-yl)-4-propan-2-ylbenzenesulfonamide;N-tert-butyl-4-propan-2-yl-2-(trifluoromethyl)benzenesulfonamide;N,2-ditert-butyl-4-propan-2-ylbenzenesulfonamide;N-ethyl-1-(4-propan-2-ylnaphthalen-1-yl)ethanamine;3-fluoro-2-(2-hydroxypropan-2-yl)-N,4-di(propan-2-yl)benzenesulfonamide;3-(2-hydroxypropan-2-yl)-N,4-di(propan-2-yl)benzenesulfonamide;N-[(4-propan-2-ylnaphthalen-1-yl)methyl]ethanamine
CID 158285090
2,2-dimethyl-1-[4-propan-2-yl-2-(trifluoromethyl)phenyl]sulfonylpyrrolidine
CID 90161756
N-(4-fluoro-2-methylbutan-2-yl)-4-methyl-2-(trifluoromethyl)benzenesulfonamide
CID 90164891
N-(1-amino-2-methylpropan-2-yl)-N-ethyl-2-(trifluoromethyl)benzenesulfonamide
CID 62008042
2-ethyl-4-propan-2-yl-1-(trifluoromethyl)benzene
CID 156849362
2-ethoxy-5-propan-2-yl-N-(2,4,4-trimethylpentan-2-yl)benzenesulfonamide
CID 91670292
ethane;2-ethyl-4-propan-2-yl-1-(trifluoromethyl)benzene
CID 177155724
2-[[4-chloro-2-(trifluoromethyl)phenyl]sulfonyl-methylamino]-N-propan-2-ylacetamide
CID 8815729

Frequently Asked Questions

What is the IUPAC name of 2-tert-butyl-N-(2-methylbutan-2-yl)-4-propan-2-ylbenzenesulfonamide;N-tert-butyl-2-(1-methylcyclopropyl)-4-propan-2-ylbenzenesulfonamide;N-tert-butyl-4-propan-2-yl-2-(trifluoromethyl)benzenesulfonamide;bis(N,2-ditert-butyl-N-ethyl-4-propan-2-ylbenzenesulfonamide);N,2-ditert-butyl-N-methyl-4-propan-2-ylbenzenesulfonamide;N-(2-methylbutan-2-yl)-4-propan-2-yl-2-(trifluoromethyl)benzenesulfonamide?
The IUPAC name of 2-tert-butyl-N-(2-methylbutan-2-yl)-4-propan-2-ylbenzenesulfonamide;N-tert-butyl-2-(1-methylcyclopropyl)-4-propan-2-ylbenzenesulfonamide;N-tert-butyl-4-propan-2-yl-2-(trifluoromethyl)benzenesulfonamide;bis(N,2-ditert-butyl-N-ethyl-4-propan-2-ylbenzenesulfonamide);N,2-ditert-butyl-N-methyl-4-propan-2-ylbenzenesulfonamide;N-(2-methylbutan-2-yl)-4-propan-2-yl-2-(trifluoromethyl)benzenesulfonamide (CID 159571538) is 2-tert-butyl-N-(2-methylbutan-2-yl)-4-propan-2-ylbenzenesulfonamide;N-tert-butyl-2-(1-methylcyclopropyl)-4-propan-2-ylbenzenesulfonamide;N-tert-butyl-4-propan-2-yl-2-(trifluoromethyl)benzenesulfonamide;bis(N,2-ditert-butyl-N-ethyl-4-propan-2-ylbenzenesulfonamide);N,2-ditert-butyl-N-methyl-4-propan-2-ylbenzenesulfonamide;N-(2-methylbutan-2-yl)-4-propan-2-yl-2-(trifluoromethyl)benzenesulfonamide.
What is the SMILES notation for 2-tert-butyl-N-(2-methylbutan-2-yl)-4-propan-2-ylbenzenesulfonamide;N-tert-butyl-2-(1-methylcyclopropyl)-4-propan-2-ylbenzenesulfonamide;N-tert-butyl-4-propan-2-yl-2-(trifluoromethyl)benzenesulfonamide;bis(N,2-ditert-butyl-N-ethyl-4-propan-2-ylbenzenesulfonamide);N,2-ditert-butyl-N-methyl-4-propan-2-ylbenzenesulfonamide;N-(2-methylbutan-2-yl)-4-propan-2-yl-2-(trifluoromethyl)benzenesulfonamide?
The canonical SMILES for 2-tert-butyl-N-(2-methylbutan-2-yl)-4-propan-2-ylbenzenesulfonamide;N-tert-butyl-2-(1-methylcyclopropyl)-4-propan-2-ylbenzenesulfonamide;N-tert-butyl-4-propan-2-yl-2-(trifluoromethyl)benzenesulfonamide;bis(N,2-ditert-butyl-N-ethyl-4-propan-2-ylbenzenesulfonamide);N,2-ditert-butyl-N-methyl-4-propan-2-ylbenzenesulfonamide;N-(2-methylbutan-2-yl)-4-propan-2-yl-2-(trifluoromethyl)benzenesulfonamide is CC(C)c1ccc(S(=O)(=O)N(C)C(C)(C)C)c(C(C)(C)C)c1.CC(C)c1ccc(S(=O)(=O)NC(C)(C)C)c(C(F)(F)F)c1.CC(C)c1ccc(S(=O)(=O)NC(C)(C)C)c(C2(C)CC2)c1.CCC(C)(C)NS(=O)(=O)c1ccc(C(C)C)cc1C(C)(C)C.CCC(C)(C)NS(=O)(=O)c1ccc(C(C)C)cc1C(F)(F)F.CCN(C(C)(C)C)S(=O)(=O)c1ccc(C(C)C)cc1C(C)(C)C.CCN(C(C)(C)C)S(=O)(=O)c1ccc(C(C)C)cc1C(C)(C)C.
What is the InChIKey of 2-tert-butyl-N-(2-methylbutan-2-yl)-4-propan-2-ylbenzenesulfonamide;N-tert-butyl-2-(1-methylcyclopropyl)-4-propan-2-ylbenzenesulfonamide;N-tert-butyl-4-propan-2-yl-2-(trifluoromethyl)benzenesulfonamide;bis(N,2-ditert-butyl-N-ethyl-4-propan-2-ylbenzenesulfonamide);N,2-ditert-butyl-N-methyl-4-propan-2-ylbenzenesulfonamide;N-(2-methylbutan-2-yl)-4-propan-2-yl-2-(trifluoromethyl)benzenesulfonamide?
The InChIKey is MHWNKPPCROMWLG-UHFFFAOYSA-N. The full InChI is InChI=1S/2C19H33NO2S.2C18H31NO2S.C17H27NO2S.C15H22F3NO2S.C14H20F3NO2S/c2*1-10-20(19(7,8)9)23(21,22)17-12-11-15(14(2)3)13-16(17)18(4,5)6;1-13(2)14-10-11-16(15(12-14)17(3,4)5)22(20,21)19(9)18(6,7)8;1-9-18(7,8)19-22(20,21)16-11-10-14(13(2)3)12-15(16)17(4,5)6;1-12(2)13-7-8-15(14(11-13)17(6)9-10-17)21(19,20)18-16(3,4)5;1-6-14(4,5)19-22(20,21)13-8-7-11(10(2)3)9-12(13)15(16,17)18;1-9(2)10-6-7-12(11(8-10)14(15,16)17)21(19,20)18-13(3,4)5/h2*11-14H,10H2,1-9H3;10-13H,1-9H3;10-13,19H,9H2,1-8H3;7-8,11-12,18H,9-10H2,1-6H3;7-10,19H,6H2,1-5H3;6-9,18H,1-5H3.
What are the key properties of 2-tert-butyl-N-(2-methylbutan-2-yl)-4-propan-2-ylbenzenesulfonamide;N-tert-butyl-2-(1-methylcyclopropyl)-4-propan-2-ylbenzenesulfonamide;N-tert-butyl-4-propan-2-yl-2-(trifluoromethyl)benzenesulfonamide;bis(N,2-ditert-butyl-N-ethyl-4-propan-2-ylbenzenesulfonamide);N,2-ditert-butyl-N-methyl-4-propan-2-ylbenzenesulfonamide;N-(2-methylbutan-2-yl)-4-propan-2-yl-2-(trifluoromethyl)benzenesulfonamide?
2-tert-butyl-N-(2-methylbutan-2-yl)-4-propan-2-ylbenzenesulfonamide;N-tert-butyl-2-(1-methylcyclopropyl)-4-propan-2-ylbenzenesulfonamide;N-tert-butyl-4-propan-2-yl-2-(trifluoromethyl)benzenesulfonamide;bis(N,2-ditert-butyl-N-ethyl-4-propan-2-ylbenzenesulfonamide);N,2-ditert-butyl-N-methyl-4-propan-2-ylbenzenesulfonamide;N-(2-methylbutan-2-yl)-4-propan-2-yl-2-(trifluoromethyl)benzenesulfonamide has a molecular weight of 2300.39 g/mol, XLogP of 31.07, 28 rotatable bonds, 4 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for 2-tert-butyl-N-(2-methylbutan-2-yl)-4-propan-2-ylbenzenesulfonamide;N-tert-butyl-2-(1-methylcyclopropyl)-4-propan-2-ylbenzenesulfonamide;N-tert-butyl-4-propan-2-yl-2-(trifluoromethyl)benzenesulfonamide;bis(N,2-ditert-butyl-N-ethyl-4-propan-2-ylbenzenesulfonamide);N,2-ditert-butyl-N-methyl-4-propan-2-ylbenzenesulfonamide;N-(2-methylbutan-2-yl)-4-propan-2-yl-2-(trifluoromethyl)benzenesulfonamide is sourced from PubChem (CID 159571538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).